N-(4-butylphenyl)-6-chloro-4-(4-methylbenzene-1-sulfonyl)-3,4-dihydro-2H-1,4-benzoxazine-2-carboxamide
Chemical Structure Depiction of
N-(4-butylphenyl)-6-chloro-4-(4-methylbenzene-1-sulfonyl)-3,4-dihydro-2H-1,4-benzoxazine-2-carboxamide
N-(4-butylphenyl)-6-chloro-4-(4-methylbenzene-1-sulfonyl)-3,4-dihydro-2H-1,4-benzoxazine-2-carboxamide
Compound characteristics
| Compound ID: | J014-2312 |
| Compound Name: | N-(4-butylphenyl)-6-chloro-4-(4-methylbenzene-1-sulfonyl)-3,4-dihydro-2H-1,4-benzoxazine-2-carboxamide |
| Molecular Weight: | 499.03 |
| Molecular Formula: | C26 H27 Cl N2 O4 S |
| Smiles: | CCCCc1ccc(cc1)NC(C1CN(c2cc(ccc2O1)[Cl])S(c1ccc(C)cc1)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.6061 |
| logD: | 6.6061 |
| logSw: | -6.1975 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.482 |
| InChI Key: | IPEIWHUDGHPYBS-RUZDIDTESA-N |