methyl 3-{[3-methyl-6-(3-methylphenyl)-1-phenyl-1,4-dihydropyrazolo[4,3-f]pyrrolo[1,2-a][1,4]diazepine-5(6H)-carbonyl]amino}thiophene-2-carboxylate
Chemical Structure Depiction of
methyl 3-{[3-methyl-6-(3-methylphenyl)-1-phenyl-1,4-dihydropyrazolo[4,3-f]pyrrolo[1,2-a][1,4]diazepine-5(6H)-carbonyl]amino}thiophene-2-carboxylate
methyl 3-{[3-methyl-6-(3-methylphenyl)-1-phenyl-1,4-dihydropyrazolo[4,3-f]pyrrolo[1,2-a][1,4]diazepine-5(6H)-carbonyl]amino}thiophene-2-carboxylate
Compound characteristics
| Compound ID: | G544-1571 |
| Compound Name: | methyl 3-{[3-methyl-6-(3-methylphenyl)-1-phenyl-1,4-dihydropyrazolo[4,3-f]pyrrolo[1,2-a][1,4]diazepine-5(6H)-carbonyl]amino}thiophene-2-carboxylate |
| Molecular Weight: | 537.64 |
| Molecular Formula: | C30 H27 N5 O3 S |
| Smiles: | Cc1cccc(c1)C1c2cccn2c2c(CN1C(Nc1ccsc1C(=O)OC)=O)c(C)nn2c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.3949 |
| logD: | 6.3947 |
| logSw: | -5.6792 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.49 |
| InChI Key: | VHSNDQBYSPSEOE-AREMUKBSSA-N |