2-chloro-N-{2-[5-(4-chlorophenyl)-3-(1-methyl-1H-pyrrol-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-[2-(morpholin-4-yl)ethyl]benzamide
Chemical Structure Depiction of
2-chloro-N-{2-[5-(4-chlorophenyl)-3-(1-methyl-1H-pyrrol-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-[2-(morpholin-4-yl)ethyl]benzamide
2-chloro-N-{2-[5-(4-chlorophenyl)-3-(1-methyl-1H-pyrrol-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-[2-(morpholin-4-yl)ethyl]benzamide
Compound characteristics
| Compound ID: | V006-4736 |
| Compound Name: | 2-chloro-N-{2-[5-(4-chlorophenyl)-3-(1-methyl-1H-pyrrol-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-[2-(morpholin-4-yl)ethyl]benzamide |
| Molecular Weight: | 568.5 |
| Molecular Formula: | C29 H31 Cl2 N5 O3 |
| Salt: | not_available |
| Smiles: | Cn1cccc1C1CC(c2ccc(cc2)[Cl])N(C(CN(CCN2CCOCC2)C(c2ccccc2[Cl])=O)=O)N=1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5231 |
| logD: | 4.5184 |
| logSw: | -4.6751 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 57.084 |
| InChI Key: | BKQFOQQKGGOPIF-MHZLTWQESA-N |