1-[(2,5-dimethylphenyl)methyl]-5-(4-methoxyphenyl)-1,3,6,7,8,9-hexahydro-2H-[1]benzothieno[2,3-e][1,4]diazepin-2-one
Chemical Structure Depiction of
1-[(2,5-dimethylphenyl)methyl]-5-(4-methoxyphenyl)-1,3,6,7,8,9-hexahydro-2H-[1]benzothieno[2,3-e][1,4]diazepin-2-one
1-[(2,5-dimethylphenyl)methyl]-5-(4-methoxyphenyl)-1,3,6,7,8,9-hexahydro-2H-[1]benzothieno[2,3-e][1,4]diazepin-2-one
Compound characteristics
| Compound ID: | G375-2859 |
| Compound Name: | 1-[(2,5-dimethylphenyl)methyl]-5-(4-methoxyphenyl)-1,3,6,7,8,9-hexahydro-2H-[1]benzothieno[2,3-e][1,4]diazepin-2-one |
| Molecular Weight: | 444.6 |
| Molecular Formula: | C27 H28 N2 O2 S |
| Smiles: | Cc1ccc(C)c(CN2C(CN=C(c3ccc(cc3)OC)c3c4CCCCc4sc23)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 6.325 |
| logD: | 6.325 |
| logSw: | -5.4435 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 31.858 |
| InChI Key: | TUAYJHWBRIXPNV-UHFFFAOYSA-N |