ethyl {4-[(3-methyl-1,6-diphenyl-1,4-dihydropyrazolo[4,3-f]pyrrolo[1,2-a][1,4]diazepine-5(6H)-carbonyl)amino]phenyl}acetate
Chemical Structure Depiction of
ethyl {4-[(3-methyl-1,6-diphenyl-1,4-dihydropyrazolo[4,3-f]pyrrolo[1,2-a][1,4]diazepine-5(6H)-carbonyl)amino]phenyl}acetate
ethyl {4-[(3-methyl-1,6-diphenyl-1,4-dihydropyrazolo[4,3-f]pyrrolo[1,2-a][1,4]diazepine-5(6H)-carbonyl)amino]phenyl}acetate
Compound characteristics
| Compound ID: | G544-0706 |
| Compound Name: | ethyl {4-[(3-methyl-1,6-diphenyl-1,4-dihydropyrazolo[4,3-f]pyrrolo[1,2-a][1,4]diazepine-5(6H)-carbonyl)amino]phenyl}acetate |
| Molecular Weight: | 545.64 |
| Molecular Formula: | C33 H31 N5 O3 |
| Smiles: | CCOC(Cc1ccc(cc1)NC(N1Cc2c(C)nn(c3ccccc3)c2n2cccc2C1c1ccccc1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.1019 |
| logD: | 6.1019 |
| logSw: | -5.4958 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.154 |
| InChI Key: | KZJRHIXVTSJVGR-WJOKGBTCSA-N |