3-(Dimethylaminomethyl)-7-azaindole 3-二甲氨基甲基-7-氮杂吲哚

CAS 5654-92-2 MFCD01580034

化学结构图

5654-92-2
SMILES: CN(C)Cc1c[nH]c2ncccc12

化学属性

Mol. FormulaC10H13N3
Mol. Weight175
Melting Point144-149
Density1.422

别名和识别编码

Chemical Name7-Azagramine
CAS Number5654-92-2
Alfabeta NameDIMETHYLPYRROLOPYRIDINYLMETHANAMINE NNHB11233[]()--------,,
MDL NumberMFCD01580034
Synonym N,N-Dimethyl-1H-pyrrolo[2,3-b]pyridine-3-methanamine 3-(Dimethylaminomethyl)-7-azaindole 3-[(Dimethylamino)methyl]-1H-Pyrrolo[2,3-b]pyridine 3-(二甲氨基甲基)-7-氮杂吲哚 3-(二甲氨基甲基)-1H-吡咯并[2,3-b]吡啶 7-Azagramine 二甲基-(1H-吡咯并[2,3-b]-3-吡啶基甲基)胺
EC Number250-023-7
Beilstein Registry Number2384789
Chemical Name Translation3-二甲氨基甲基-7-氮杂吲哚
LabNetwork Molecule IDLN00167830
PubChem Substance ID5383549
InChIInChI=1S/C10H13N3/c1-13(2)7-8-6-12-10-9(8)4-3-5-11-10/h3-6H,7H2,1-2H3,(H,11,12)
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分类

  • Aromatics
  • Heterocycles
  • Indole Derivatives
  • {KO} AminesSecondaryHeteroNH
  • Amines
  • {SNA} Azaindoles, Building Blocks, C10, Chemical Synthesis, Heterocyclic Building Blocks, Indoles

产品应用

  • 7-Azaindole derivative

相关文献及参考

  • Showell, G., et al.: Bioorg. Med. Chem., 6, 1 (1998),

安全信息

Warnings IRRITANT
Signal word Danger
GHS Symbol
WGK Germany3
Safety Statements
  • S26 In case of contact with eyes, rinse immediately with plenty of water and seek medical advice 眼睛接触后，立即用大量水冲洗并征求医生意见；
  • S36/37/39 Wear suitable protective clothing, gloves and eye/face protection 穿戴适当的防护服、手套和眼睛/面保护；
Risk Statements
  • R22 Harmful if swallowed 吞咽有害
  • R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性
  • R37/38 Irritating to respiratory system and skin 对呼吸系统和皮肤有刺激性
  • R41 Risk of serious damage to eyes 有严重损伤眼睛的危险
Precautionary statements
  • P261 Avoid breathing dust/fume/gas/mist/vapours/spray. 避免吸入粉尘/烟/气体/烟雾/蒸汽/喷雾。
  • P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
  • P264+P265
  • P270 Do not eat, drink or smoke when using this product. 使用本产品时不要吃东西，喝水或吸烟。
  • P271 Use only outdoors or in a well-ventilated area.? 只能在室外或通风良好的地方使用。
  • P280 Wear protective gloves/protective clothing/eye protection/face protection. 戴防护手套/防护服/眼睛的保护物/面部保护物。
  • P301+P312
  • P301+P317
  • P302+P352
  • P304+P340
  • P305+P351+P338
  • P305+P354+P338
  • P310 Immediately call a POISON CENTER or doctor/physician. 立即呼救解毒中心或医生/医师。
  • P312 Call a POISON CENTER or doctor/physician if you feel unwell. 如果你感觉不适，呼叫解毒中心或医生/医师。
  • P317
  • P319
  • P321 Specific treatment (see … on this label). 具体治疗（见本标签上的）。
  • P330 Rinse mouth. 漱口
  • P332+P313
  • P332+P317
  • P362 Take off contaminated clothing and wash before reuse. 脱掉污染的衣服，清洗后方可重新使用
  • P362+P364
  • P403+P233
  • P405 Store locked up. 上锁保管。
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
Hazard statements
  • H302 Harmful if swallowed 吞食有害
  • H315 Causes skin irritation 会刺激皮肤
  • H318 Causes serious eye damage 严重伤害眼睛
  • H335 May cause respiratory irritation 可能导致呼吸道刺激
Personal Protective Equipment dust mask type N95 (US), Eyeshields, Gloves
Hazard Codes Xn

药物吸收、分布、代谢与排泄(ADME)

Lipinski's Rule of 3
Y
Lipinski's Rule of 5
Y
H-bond Donors
1
H-bond Acceptors
2
Rotatable Bonds
2
LogP
1

系列性分类

  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Heterocyclic Building Blocks 杂环合成砌块
  4. Azaindoles
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Heterocyclic Building Blocks 杂环合成砌块
  4. Indoles 吲哚
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Heterocyclic Building Blocks 杂环合成砌块
  4. Indolines 吲哚啉

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