N-(4-bromophenyl)-2-propanamido-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide
Chemical Structure Depiction of
N-(4-bromophenyl)-2-propanamido-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide
N-(4-bromophenyl)-2-propanamido-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide
Compound characteristics
| Compound ID: | 3261-0740 |
| Compound Name: | N-(4-bromophenyl)-2-propanamido-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide |
| Molecular Weight: | 421.35 |
| Molecular Formula: | C19 H21 Br N2 O2 S |
| Smiles: | CCC(Nc1c(C(Nc2ccc(cc2)[Br])=O)c2CCCCCc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2228 |
| logD: | 5.0878 |
| logSw: | -5.0506 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 46.525 |
| InChI Key: | OGMLFITWRFVERK-UHFFFAOYSA-N |