5-benzyl-N-(butan-2-yl)-N-(3-{[2-(diethylamino)ethyl]amino}-3-oxopropyl)-4-oxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide
Chemical Structure Depiction of
5-benzyl-N-(butan-2-yl)-N-(3-{[2-(diethylamino)ethyl]amino}-3-oxopropyl)-4-oxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide
5-benzyl-N-(butan-2-yl)-N-(3-{[2-(diethylamino)ethyl]amino}-3-oxopropyl)-4-oxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide
Compound characteristics
| Compound ID: | V022-5944 |
| Compound Name: | 5-benzyl-N-(butan-2-yl)-N-(3-{[2-(diethylamino)ethyl]amino}-3-oxopropyl)-4-oxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide |
| Molecular Weight: | 510.68 |
| Molecular Formula: | C28 H42 N6 O3 |
| Salt: | not_available |
| Smiles: | CCC(C)N(CCC(NCCN(CC)CC)=O)C(c1cc2C(N(CCCn2n1)Cc1ccccc1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.4201 |
| logD: | 0.5731 |
| logSw: | -2.8592 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.895 |
| InChI Key: | QKFPQXOEVUUYIZ-QFIPXVFZSA-N |