N-{2-[(3S)-2,5-dioxo-2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-3-yl]ethyl}-4-(4-oxo-3,4-dihydroquinazolin-2-yl)butanamide
Chemical Structure Depiction of
N-{2-[(3S)-2,5-dioxo-2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-3-yl]ethyl}-4-(4-oxo-3,4-dihydroquinazolin-2-yl)butanamide
N-{2-[(3S)-2,5-dioxo-2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-3-yl]ethyl}-4-(4-oxo-3,4-dihydroquinazolin-2-yl)butanamide
Compound characteristics
| Compound ID: | D756-0003 |
| Compound Name: | N-{2-[(3S)-2,5-dioxo-2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-3-yl]ethyl}-4-(4-oxo-3,4-dihydroquinazolin-2-yl)butanamide |
| Molecular Weight: | 433.47 |
| Molecular Formula: | C23 H23 N5 O4 |
| Smiles: | C(CC1NC(c2ccccc2N=1)=O)CC(NCC[C@H]1C(Nc2ccccc2C(N1)=O)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 0.5484 |
| logD: | 0.5378 |
| logSw: | -2.3584 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 110.197 |
| InChI Key: | NTQRDEDNHCBHJG-SFHVURJKSA-N |