methyl {5-[2-(4-ethoxyanilino)-2-oxoethyl]-7,8-dimethyl-4-oxo-4,5-dihydro-1H-1,5-benzodiazepin-2-yl}acetate
Chemical Structure Depiction of
methyl {5-[2-(4-ethoxyanilino)-2-oxoethyl]-7,8-dimethyl-4-oxo-4,5-dihydro-1H-1,5-benzodiazepin-2-yl}acetate
methyl {5-[2-(4-ethoxyanilino)-2-oxoethyl]-7,8-dimethyl-4-oxo-4,5-dihydro-1H-1,5-benzodiazepin-2-yl}acetate
Compound characteristics
| Compound ID: | F404-0500 |
| Compound Name: | methyl {5-[2-(4-ethoxyanilino)-2-oxoethyl]-7,8-dimethyl-4-oxo-4,5-dihydro-1H-1,5-benzodiazepin-2-yl}acetate |
| Molecular Weight: | 437.49 |
| Molecular Formula: | C24 H27 N3 O5 |
| Smiles: | CCOc1ccc(cc1)NC(CN1C(C=C(CC(=O)OC)Nc2cc(C)c(C)cc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7431 |
| logD: | 3.4145 |
| logSw: | -4.1187 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.428 |
| InChI Key: | ZCWMLUXBBNMRQM-UHFFFAOYSA-N |