6-chloro-4-(4-methylbenzene-1-sulfonyl)-N-{3-[(prop-2-en-1-yl)oxy]phenyl}-3,4-dihydro-2H-1,4-benzoxazine-2-carboxamide
Chemical Structure Depiction of
6-chloro-4-(4-methylbenzene-1-sulfonyl)-N-{3-[(prop-2-en-1-yl)oxy]phenyl}-3,4-dihydro-2H-1,4-benzoxazine-2-carboxamide
6-chloro-4-(4-methylbenzene-1-sulfonyl)-N-{3-[(prop-2-en-1-yl)oxy]phenyl}-3,4-dihydro-2H-1,4-benzoxazine-2-carboxamide
Compound characteristics
| Compound ID: | J014-2316 |
| Compound Name: | 6-chloro-4-(4-methylbenzene-1-sulfonyl)-N-{3-[(prop-2-en-1-yl)oxy]phenyl}-3,4-dihydro-2H-1,4-benzoxazine-2-carboxamide |
| Molecular Weight: | 498.98 |
| Molecular Formula: | C25 H23 Cl N2 O5 S |
| Smiles: | Cc1ccc(cc1)S(N1CC(C(Nc2cccc(c2)OCC=C)=O)Oc2ccc(cc12)[Cl])(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.2549 |
| logD: | 5.2548 |
| logSw: | -5.6718 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.9 |
| InChI Key: | JMQAHSVTOJNINL-XMMPIXPASA-N |