3-{[4-(azepane-1-carbonyl)cyclohexyl]methyl}-1-[(2-methylphenyl)methyl]thieno[3,2-d]pyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
3-{[4-(azepane-1-carbonyl)cyclohexyl]methyl}-1-[(2-methylphenyl)methyl]thieno[3,2-d]pyrimidine-2,4(1H,3H)-dione
3-{[4-(azepane-1-carbonyl)cyclohexyl]methyl}-1-[(2-methylphenyl)methyl]thieno[3,2-d]pyrimidine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | G346-0472 |
| Compound Name: | 3-{[4-(azepane-1-carbonyl)cyclohexyl]methyl}-1-[(2-methylphenyl)methyl]thieno[3,2-d]pyrimidine-2,4(1H,3H)-dione |
| Molecular Weight: | 493.67 |
| Molecular Formula: | C28 H35 N3 O3 S |
| Smiles: | Cc1ccccc1CN1C(N(CC2CCC(CC2)C(N2CCCCCC2)=O)C(c2c1ccs2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.3936 |
| logD: | 6.3936 |
| logSw: | -5.5799 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 49.457 |
| InChI Key: | GMABPBIINDBCDA-UHFFFAOYSA-N |