N-(butan-2-yl)-N-{2-[({1-[(2-chlorophenyl)methyl]-1H-pyrrol-2-yl}methyl)(2-methylpropyl)amino]-2-oxoethyl}-3-(trifluoromethyl)benzamide
Chemical Structure Depiction of
N-(butan-2-yl)-N-{2-[({1-[(2-chlorophenyl)methyl]-1H-pyrrol-2-yl}methyl)(2-methylpropyl)amino]-2-oxoethyl}-3-(trifluoromethyl)benzamide
N-(butan-2-yl)-N-{2-[({1-[(2-chlorophenyl)methyl]-1H-pyrrol-2-yl}methyl)(2-methylpropyl)amino]-2-oxoethyl}-3-(trifluoromethyl)benzamide
Compound characteristics
| Compound ID: | V011-6030 |
| Compound Name: | N-(butan-2-yl)-N-{2-[({1-[(2-chlorophenyl)methyl]-1H-pyrrol-2-yl}methyl)(2-methylpropyl)amino]-2-oxoethyl}-3-(trifluoromethyl)benzamide |
| Molecular Weight: | 562.08 |
| Molecular Formula: | C30 H35 Cl F3 N3 O2 |
| Smiles: | CCC(C)N(CC(N(CC(C)C)Cc1cccn1Cc1ccccc1[Cl])=O)C(c1cccc(c1)C(F)(F)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.9177 |
| logD: | 6.9177 |
| logSw: | -6.4308 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 33.803 |
| InChI Key: | BBEHHUVMANNLCP-QFIPXVFZSA-N |