3-[5-bromo-1-(cyclopropanecarbonyl)-2,3-dihydro-1H-indole-6-sulfonyl]-1-{4-[(4-chlorophenyl)(phenyl)methyl]piperazin-1-yl}propan-1-one
Chemical Structure Depiction of
3-[5-bromo-1-(cyclopropanecarbonyl)-2,3-dihydro-1H-indole-6-sulfonyl]-1-{4-[(4-chlorophenyl)(phenyl)methyl]piperazin-1-yl}propan-1-one
3-[5-bromo-1-(cyclopropanecarbonyl)-2,3-dihydro-1H-indole-6-sulfonyl]-1-{4-[(4-chlorophenyl)(phenyl)methyl]piperazin-1-yl}propan-1-one
Compound characteristics
| Compound ID: | C300-0054 |
| Compound Name: | 3-[5-bromo-1-(cyclopropanecarbonyl)-2,3-dihydro-1H-indole-6-sulfonyl]-1-{4-[(4-chlorophenyl)(phenyl)methyl]piperazin-1-yl}propan-1-one |
| Molecular Weight: | 671.05 |
| Molecular Formula: | C32 H33 Br Cl N3 O4 S |
| Smiles: | C(CS(c1cc2c(CCN2C(C2CC2)=O)cc1[Br])(=O)=O)C(N1CCN(CC1)C(c1ccccc1)c1ccc(cc1)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.4399 |
| logD: | 5.4389 |
| logSw: | -6.1543 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 64.159 |
| InChI Key: | AKNCRIQPBFWOME-HKBQPEDESA-N |