N-(3-chloro-4-fluorophenyl)-7-methyl-4-(4-methylbenzene-1-sulfonyl)-3,4-dihydro-2H-1,4-benzoxazine-2-carboxamide
Chemical Structure Depiction of
N-(3-chloro-4-fluorophenyl)-7-methyl-4-(4-methylbenzene-1-sulfonyl)-3,4-dihydro-2H-1,4-benzoxazine-2-carboxamide
N-(3-chloro-4-fluorophenyl)-7-methyl-4-(4-methylbenzene-1-sulfonyl)-3,4-dihydro-2H-1,4-benzoxazine-2-carboxamide
Compound characteristics
| Compound ID: | J014-2090 |
| Compound Name: | N-(3-chloro-4-fluorophenyl)-7-methyl-4-(4-methylbenzene-1-sulfonyl)-3,4-dihydro-2H-1,4-benzoxazine-2-carboxamide |
| Molecular Weight: | 474.94 |
| Molecular Formula: | C23 H20 Cl F N2 O4 S |
| Smiles: | Cc1ccc(cc1)S(N1CC(C(Nc2ccc(c(c2)[Cl])F)=O)Oc2cc(C)ccc12)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.2366 |
| logD: | 5.1728 |
| logSw: | -5.6347 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.482 |
| InChI Key: | XMVNJRDKUZFOOZ-QFIPXVFZSA-N |