N~3~-(1,3-dimethyl-2,4-dioxo-1,2,3,4-tetrahydroquinazoline-6-sulfonyl)-N-[2-(4-methylphenyl)ethyl]-beta-alaninamide
Chemical Structure Depiction of
N~3~-(1,3-dimethyl-2,4-dioxo-1,2,3,4-tetrahydroquinazoline-6-sulfonyl)-N-[2-(4-methylphenyl)ethyl]-beta-alaninamide
N~3~-(1,3-dimethyl-2,4-dioxo-1,2,3,4-tetrahydroquinazoline-6-sulfonyl)-N-[2-(4-methylphenyl)ethyl]-beta-alaninamide
Compound characteristics
| Compound ID: | C648-0448 |
| Compound Name: | N~3~-(1,3-dimethyl-2,4-dioxo-1,2,3,4-tetrahydroquinazoline-6-sulfonyl)-N-[2-(4-methylphenyl)ethyl]-beta-alaninamide |
| Molecular Weight: | 458.54 |
| Molecular Formula: | C22 H26 N4 O5 S |
| Smiles: | Cc1ccc(CCNC(CCNS(c2ccc3c(c2)C(N(C)C(N3C)=O)=O)(=O)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 1.6456 |
| logD: | 1.6454 |
| logSw: | -2.8376 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 97.254 |
| InChI Key: | QFZQQDONSKWFGE-UHFFFAOYSA-N |