2-{[1-(4-bromophenyl)cyclopentane-1-carbonyl]amino}-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Chemical Structure Depiction of
2-{[1-(4-bromophenyl)cyclopentane-1-carbonyl]amino}-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
2-{[1-(4-bromophenyl)cyclopentane-1-carbonyl]amino}-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Compound characteristics
| Compound ID: | J029-0108 |
| Compound Name: | 2-{[1-(4-bromophenyl)cyclopentane-1-carbonyl]amino}-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide |
| Molecular Weight: | 461.42 |
| Molecular Formula: | C22 H25 Br N2 O2 S |
| Smiles: | CC1CCc2c(C(N)=O)c(NC(C3(CCCC3)c3ccc(cc3)[Br])=O)sc2C1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.587 |
| logD: | 3.0016 |
| logSw: | -4.7124 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 57.39 |
| InChI Key: | KMLGUKWTOIQLMI-CYBMUJFWSA-N |