2-(2,5-Dimethyl-1H-pyrrol-1-yl)-3-thiophenecarboxylic acid
CAS 478077-98-4 MFCD01312401
化学结构图
SMILES: CC1=CC=C(C)N1C1SC=CC=1C(O)=O
化学属性
| Mol. Formula | C11H11NO2S |
|---|---|
| Mol. Weight | 221 |
| Melting Point | 188-190° |
别名和识别编码
| Chemical Name | 2-(2,5-dimethyl-1H-pyrrol-1-yl)-3-thiophenecarboxylic acid |
|---|---|
| Alfabeta Name | DIMETHYLPYRROLYLTHIOPHENECARBOXYLICACID H225113()--------, |
| MDL Number | MFCD01312401 |
| CAS Number | 478077-98-4 |
| Synonym | 2-(2,5-dimethyl-1H-pyrrol-1-yl)-3-thiophenecarboxylic acid |
| PubChem Substance ID | 329789646 |
| Chemical Name Translation |
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分类
- {KO} CarboxylicAcids
- {SNA} Building Blocks, C10 to C20+, Chemical Synthesis, Heterocyclic Building Blocks, Pyrroles, Thiophenes
安全信息
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 Acceptors
2
Rotatable Bonds
2
H-bond Donors
1
LogP
2
