ethyl 5-{[5-(4-methoxyphenyl)-2-oxo-2,3,6,7,8,9-hexahydro-1H-[1]benzothieno[2,3-e][1,4]diazepin-1-yl]methyl}-1,2-oxazole-3-carboxylate
Chemical Structure Depiction of
ethyl 5-{[5-(4-methoxyphenyl)-2-oxo-2,3,6,7,8,9-hexahydro-1H-[1]benzothieno[2,3-e][1,4]diazepin-1-yl]methyl}-1,2-oxazole-3-carboxylate
ethyl 5-{[5-(4-methoxyphenyl)-2-oxo-2,3,6,7,8,9-hexahydro-1H-[1]benzothieno[2,3-e][1,4]diazepin-1-yl]methyl}-1,2-oxazole-3-carboxylate
Compound characteristics
| Compound ID: | G375-2877 |
| Compound Name: | ethyl 5-{[5-(4-methoxyphenyl)-2-oxo-2,3,6,7,8,9-hexahydro-1H-[1]benzothieno[2,3-e][1,4]diazepin-1-yl]methyl}-1,2-oxazole-3-carboxylate |
| Molecular Weight: | 479.55 |
| Molecular Formula: | C25 H25 N3 O5 S |
| Smiles: | CCOC(c1cc(CN2C(CN=C(c3ccc(cc3)OC)c3c4CCCCc4sc23)=O)on1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3826 |
| logD: | 4.3826 |
| logSw: | -4.5131 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 73.589 |
| InChI Key: | NGPXGWZYUYXYSO-UHFFFAOYSA-N |