4-({[4-methyl-2-(1H-pyrrol-1-yl)-1,3-thiazole-5-carbonyl]amino}methyl)cyclohexane-1-carboxylic acid
Chemical Structure Depiction of
4-({[4-methyl-2-(1H-pyrrol-1-yl)-1,3-thiazole-5-carbonyl]amino}methyl)cyclohexane-1-carboxylic acid
4-({[4-methyl-2-(1H-pyrrol-1-yl)-1,3-thiazole-5-carbonyl]amino}methyl)cyclohexane-1-carboxylic acid
Compound characteristics
| Compound ID: | Y043-0200 |
| Compound Name: | 4-({[4-methyl-2-(1H-pyrrol-1-yl)-1,3-thiazole-5-carbonyl]amino}methyl)cyclohexane-1-carboxylic acid |
| Molecular Weight: | 347.43 |
| Molecular Formula: | C17 H21 N3 O3 S |
| Smiles: | Cc1c(C(NC[C@H]2CC[C@@H](CC2)C(O)=O)=O)sc(n1)n1cccc1 |
| Stereo: | ACHIRAL |
| logP: | 2.6962 |
| logD: | 0.1359 |
| logSw: | -2.6793 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.635 |
| InChI Key: | NBXANQDWGJQDHF-UHFFFAOYSA-N |