4-[7-methyl-4-(4-methylbenzene-1-sulfonyl)-3,4-dihydro-2H-1,4-benzoxazine-2-carbonyl]-3,4-dihydroquinoxalin-2(1H)-one
Chemical Structure Depiction of
4-[7-methyl-4-(4-methylbenzene-1-sulfonyl)-3,4-dihydro-2H-1,4-benzoxazine-2-carbonyl]-3,4-dihydroquinoxalin-2(1H)-one
4-[7-methyl-4-(4-methylbenzene-1-sulfonyl)-3,4-dihydro-2H-1,4-benzoxazine-2-carbonyl]-3,4-dihydroquinoxalin-2(1H)-one
Compound characteristics
| Compound ID: | J014-2136 |
| Compound Name: | 4-[7-methyl-4-(4-methylbenzene-1-sulfonyl)-3,4-dihydro-2H-1,4-benzoxazine-2-carbonyl]-3,4-dihydroquinoxalin-2(1H)-one |
| Molecular Weight: | 477.54 |
| Molecular Formula: | C25 H23 N3 O5 S |
| Smiles: | Cc1ccc(cc1)S(N1CC(C(N2CC(Nc3ccccc23)=O)=O)Oc2cc(C)ccc12)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.608 |
| logD: | 3.6067 |
| logSw: | -3.8682 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.538 |
| InChI Key: | HLSWRGPWXGIZOF-HSZRJFAPSA-N |