methyl 2-{[6-(3-methoxyphenyl)-3-methyl-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-{[6-(3-methoxyphenyl)-3-methyl-1-phenyl-1,4-dihydropyrazolo[4,3-f]pyrrolo[1,2-a][1,4]diazepine-5(6H)-carbonyl]amino}benzoate
methyl 2-{[6-(3-methoxyphenyl)-3-methyl-1-phenyl-1,4-dihydropyrazolo[4,3-f]pyrrolo[1,2-a][1,4]diazepine-5(6H)-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | G544-1645 |
| Compound Name: | methyl 2-{[6-(3-methoxyphenyl)-3-methyl-1-phenyl-1,4-dihydropyrazolo[4,3-f]pyrrolo[1,2-a][1,4]diazepine-5(6H)-carbonyl]amino}benzoate |
| Molecular Weight: | 547.61 |
| Molecular Formula: | C32 H29 N5 O4 |
| Smiles: | Cc1c2CN(C(c3cccc(c3)OC)c3cccn3c2n(c2ccccc2)n1)C(Nc1ccccc1C(=O)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.1832 |
| logD: | 6.1831 |
| logSw: | -5.564 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.015 |
| InChI Key: | JCEFUQLUMHBHJU-GDLZYMKVSA-N |