methyl 2-[3-(2,5-dioxo-2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-3-yl)propanamido]-4-methyl-1,3-thiazole-5-carboxylate
Chemical Structure Depiction of
methyl 2-[3-(2,5-dioxo-2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-3-yl)propanamido]-4-methyl-1,3-thiazole-5-carboxylate
methyl 2-[3-(2,5-dioxo-2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-3-yl)propanamido]-4-methyl-1,3-thiazole-5-carboxylate
Compound characteristics
| Compound ID: | Y043-3352 |
| Compound Name: | methyl 2-[3-(2,5-dioxo-2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-3-yl)propanamido]-4-methyl-1,3-thiazole-5-carboxylate |
| Molecular Weight: | 402.43 |
| Molecular Formula: | C18 H18 N4 O5 S |
| Smiles: | Cc1c(C(=O)OC)sc(NC(CCC2C(Nc3ccccc3C(N2)=O)=O)=O)n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.077 |
| logD: | 2.0006 |
| logSw: | -2.9211 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 105.897 |
| InChI Key: | OISCZZKTXFMKIV-GFCCVEGCSA-N |