N-(3-{[2-(diethylamino)ethyl]amino}-3-oxopropyl)-5-[(3-methylphenyl)methyl]-4-oxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide
Chemical Structure Depiction of
N-(3-{[2-(diethylamino)ethyl]amino}-3-oxopropyl)-5-[(3-methylphenyl)methyl]-4-oxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide
N-(3-{[2-(diethylamino)ethyl]amino}-3-oxopropyl)-5-[(3-methylphenyl)methyl]-4-oxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide
Compound characteristics
| Compound ID: | V016-6885 |
| Compound Name: | N-(3-{[2-(diethylamino)ethyl]amino}-3-oxopropyl)-5-[(3-methylphenyl)methyl]-4-oxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide |
| Molecular Weight: | 468.6 |
| Molecular Formula: | C25 H36 N6 O3 |
| Salt: | not_available |
| Smiles: | CCN(CC)CCNC(CCNC(c1cc2C(N(CCCn2n1)Cc1cccc(C)c1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.2894 |
| logD: | -0.5575 |
| logSw: | -2.1547 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.632 |
| InChI Key: | NZLIMMIRXRTQON-UHFFFAOYSA-N |