ethyl 2-[(1,4,5,6,7,8-hexahydrocyclohepta[c]pyrazole-3-carbonyl)amino]-1,3-thiazole-4-carboxylate
Chemical Structure Depiction of
ethyl 2-[(1,4,5,6,7,8-hexahydrocyclohepta[c]pyrazole-3-carbonyl)amino]-1,3-thiazole-4-carboxylate
ethyl 2-[(1,4,5,6,7,8-hexahydrocyclohepta[c]pyrazole-3-carbonyl)amino]-1,3-thiazole-4-carboxylate
Compound characteristics
| Compound ID: | Y043-4712 |
| Compound Name: | ethyl 2-[(1,4,5,6,7,8-hexahydrocyclohepta[c]pyrazole-3-carbonyl)amino]-1,3-thiazole-4-carboxylate |
| Molecular Weight: | 334.39 |
| Molecular Formula: | C15 H18 N4 O3 S |
| Smiles: | CCOC(c1csc(NC(c2c3CCCCCc3[nH]n2)=O)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.081 |
| logD: | 3.0131 |
| logSw: | -3.2508 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.414 |
| InChI Key: | NZPQOOSPVCXIHZ-UHFFFAOYSA-N |