N-{3-[benzyl(methyl)amino]propyl}-N~2~-(1,3-dimethyl-2,4-dioxo-1,2,3,4-tetrahydroquinazoline-6-sulfonyl)-N~2~-methylglycinamide
Chemical Structure Depiction of
N-{3-[benzyl(methyl)amino]propyl}-N~2~-(1,3-dimethyl-2,4-dioxo-1,2,3,4-tetrahydroquinazoline-6-sulfonyl)-N~2~-methylglycinamide
N-{3-[benzyl(methyl)amino]propyl}-N~2~-(1,3-dimethyl-2,4-dioxo-1,2,3,4-tetrahydroquinazoline-6-sulfonyl)-N~2~-methylglycinamide
Compound characteristics
| Compound ID: | C597-0750 |
| Compound Name: | N-{3-[benzyl(methyl)amino]propyl}-N~2~-(1,3-dimethyl-2,4-dioxo-1,2,3,4-tetrahydroquinazoline-6-sulfonyl)-N~2~-methylglycinamide |
| Molecular Weight: | 501.6 |
| Molecular Formula: | C24 H31 N5 O5 S |
| Smiles: | CN(CCCNC(CN(C)S(c1ccc2c(c1)C(N(C)C(N2C)=O)=O)(=O)=O)=O)Cc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 1.2687 |
| logD: | -0.2285 |
| logSw: | -2.7178 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 92.313 |
| InChI Key: | YXNJIIYAQJLNDN-UHFFFAOYSA-N |