4-bromo-N-(3-carbamoyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-1-methyl-1H-pyrazole-5-carboxamide
Chemical Structure Depiction of
4-bromo-N-(3-carbamoyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-1-methyl-1H-pyrazole-5-carboxamide
4-bromo-N-(3-carbamoyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-1-methyl-1H-pyrazole-5-carboxamide
Compound characteristics
| Compound ID: | Y502-0032 |
| Compound Name: | 4-bromo-N-(3-carbamoyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-1-methyl-1H-pyrazole-5-carboxamide |
| Molecular Weight: | 397.29 |
| Molecular Formula: | C15 H17 Br N4 O2 S |
| Smiles: | Cn1c(C(Nc2c(C(N)=O)c3CCCCCc3s2)=O)c(cn1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 1.6713 |
| logD: | -0.9024 |
| logSw: | -2.3895 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 70.95 |
| InChI Key: | HMCZRQADRZSVJZ-UHFFFAOYSA-N |