3-{4-[2-(azepan-1-yl)-2-oxoethyl]phenyl}-1-[(4-methylphenyl)methyl]quinazoline-2,4(1H,3H)-dione
Chemical Structure Depiction of
3-{4-[2-(azepan-1-yl)-2-oxoethyl]phenyl}-1-[(4-methylphenyl)methyl]quinazoline-2,4(1H,3H)-dione
3-{4-[2-(azepan-1-yl)-2-oxoethyl]phenyl}-1-[(4-methylphenyl)methyl]quinazoline-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | F144-0558 |
| Compound Name: | 3-{4-[2-(azepan-1-yl)-2-oxoethyl]phenyl}-1-[(4-methylphenyl)methyl]quinazoline-2,4(1H,3H)-dione |
| Molecular Weight: | 481.59 |
| Molecular Formula: | C30 H31 N3 O3 |
| Smiles: | Cc1ccc(CN2C(N(C(c3ccccc23)=O)c2ccc(CC(N3CCCCCC3)=O)cc2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.6068 |
| logD: | 4.6068 |
| logSw: | -4.4 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 47.107 |
| InChI Key: | IXSHFCJMCQWJHE-UHFFFAOYSA-N |