3-[2-(azepan-1-yl)-2-oxoethyl]-1-methyl-6-(2-methylpiperidine-1-sulfonyl)quinazoline-2,4(1H,3H)-dione
Chemical Structure Depiction of
3-[2-(azepan-1-yl)-2-oxoethyl]-1-methyl-6-(2-methylpiperidine-1-sulfonyl)quinazoline-2,4(1H,3H)-dione
3-[2-(azepan-1-yl)-2-oxoethyl]-1-methyl-6-(2-methylpiperidine-1-sulfonyl)quinazoline-2,4(1H,3H)-dione
Compound characteristics
Compound ID: | L596-0463 |
Compound Name: | 3-[2-(azepan-1-yl)-2-oxoethyl]-1-methyl-6-(2-methylpiperidine-1-sulfonyl)quinazoline-2,4(1H,3H)-dione |
Molecular Weight: | 476.59 |
Molecular Formula: | C23 H32 N4 O5 S |
Smiles: | CC1CCCCN1S(c1ccc2c(c1)C(N(CC(N1CCCCCC1)=O)C(N2C)=O)=O)(=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 2.1858 |
logD: | 2.1858 |
logSw: | -3.0405 |
Hydrogen bond acceptors count: | 11 |
Polar surface area: | 79.8 |
InChI Key: | XYGSJDUFGARJEJ-KRWDZBQOSA-N |