4-(benzenesulfonyl)-6-tert-butyl-N-(2,4-dimethylpentan-3-yl)-3,4-dihydro-2H-1,4-benzoxazine-2-carboxamide
Chemical Structure Depiction of
4-(benzenesulfonyl)-6-tert-butyl-N-(2,4-dimethylpentan-3-yl)-3,4-dihydro-2H-1,4-benzoxazine-2-carboxamide
4-(benzenesulfonyl)-6-tert-butyl-N-(2,4-dimethylpentan-3-yl)-3,4-dihydro-2H-1,4-benzoxazine-2-carboxamide
Compound characteristics
Compound ID: | J014-1654 |
Compound Name: | 4-(benzenesulfonyl)-6-tert-butyl-N-(2,4-dimethylpentan-3-yl)-3,4-dihydro-2H-1,4-benzoxazine-2-carboxamide |
Molecular Weight: | 472.65 |
Molecular Formula: | C26 H36 N2 O4 S |
Smiles: | CC(C)C(C(C)C)NC(C1CN(c2cc(ccc2O1)C(C)(C)C)S(c1ccccc1)(=O)=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 6.2283 |
logD: | 6.2283 |
logSw: | -5.4654 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 62.428 |
InChI Key: | CFIRKWBAJANTPD-HSZRJFAPSA-N |