methyl 2-{[1-(4-bromophenyl)cyclopentane-1-carbonyl]amino}benzoate
Chemical Structure Depiction of
methyl 2-{[1-(4-bromophenyl)cyclopentane-1-carbonyl]amino}benzoate
methyl 2-{[1-(4-bromophenyl)cyclopentane-1-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | J029-1667 |
| Compound Name: | methyl 2-{[1-(4-bromophenyl)cyclopentane-1-carbonyl]amino}benzoate |
| Molecular Weight: | 402.29 |
| Molecular Formula: | C20 H20 Br N O3 |
| Smiles: | COC(c1ccccc1NC(C1(CCCC1)c1ccc(cc1)[Br])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1024 |
| logD: | 4.745 |
| logSw: | -4.8388 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.092 |
| InChI Key: | XNTWMFQSHUJPFE-UHFFFAOYSA-N |