methyl 2-{[3-methyl-6-(3-methylphenyl)-1-phenyl-1,4-dihydropyrazolo[4,3-f]pyrrolo[1,2-a][1,4]diazepine-5(6H)-carbonyl]amino}benzoate
Chemical Structure Depiction of
methyl 2-{[3-methyl-6-(3-methylphenyl)-1-phenyl-1,4-dihydropyrazolo[4,3-f]pyrrolo[1,2-a][1,4]diazepine-5(6H)-carbonyl]amino}benzoate
methyl 2-{[3-methyl-6-(3-methylphenyl)-1-phenyl-1,4-dihydropyrazolo[4,3-f]pyrrolo[1,2-a][1,4]diazepine-5(6H)-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | G544-1518 |
| Compound Name: | methyl 2-{[3-methyl-6-(3-methylphenyl)-1-phenyl-1,4-dihydropyrazolo[4,3-f]pyrrolo[1,2-a][1,4]diazepine-5(6H)-carbonyl]amino}benzoate |
| Molecular Weight: | 531.61 |
| Molecular Formula: | C32 H29 N5 O3 |
| Smiles: | Cc1cccc(c1)C1c2cccn2c2c(CN1C(Nc1ccccc1C(=O)OC)=O)c(C)nn2c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.7011 |
| logD: | 6.701 |
| logSw: | -5.7301 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.472 |
| InChI Key: | BEQSRFSCQPZWJM-GDLZYMKVSA-N |