ethyl (2-{2-[(3R)-2,5-dioxo-2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-3-yl]acetamido}-1,3-thiazol-4-yl)acetate
Chemical Structure Depiction of
ethyl (2-{2-[(3R)-2,5-dioxo-2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-3-yl]acetamido}-1,3-thiazol-4-yl)acetate
ethyl (2-{2-[(3R)-2,5-dioxo-2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-3-yl]acetamido}-1,3-thiazol-4-yl)acetate
Compound characteristics
| Compound ID: | J100-0169 |
| Compound Name: | ethyl (2-{2-[(3R)-2,5-dioxo-2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-3-yl]acetamido}-1,3-thiazol-4-yl)acetate |
| Molecular Weight: | 402.43 |
| Molecular Formula: | C18 H18 N4 O5 S |
| Smiles: | CCOC(Cc1csc(NC(C[C@@H]2C(Nc3ccccc3C(N2)=O)=O)=O)n1)=O |
| Stereo: | ABSOLUTE |
| logP: | 1.6475 |
| logD: | 1.6351 |
| logSw: | -2.7369 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 104.8 |
| InChI Key: | LFBMRGKHQWYDSA-CYBMUJFWSA-N |