N-benzyl-4-(6-chloro-2-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)piperazine-1-carboxamide
Chemical Structure Depiction of
N-benzyl-4-(6-chloro-2-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)piperazine-1-carboxamide
N-benzyl-4-(6-chloro-2-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)piperazine-1-carboxamide
Compound characteristics
Compound ID: | F823-0219 |
Compound Name: | N-benzyl-4-(6-chloro-2-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)piperazine-1-carboxamide |
Molecular Weight: | 478.95 |
Molecular Formula: | C21 H23 Cl N4 O5 S |
Smiles: | CC1C(Nc2cc(c(cc2O1)S(N1CCN(CC1)C(NCc1ccccc1)=O)(=O)=O)[Cl])=O |
Stereo: | RACEMIC MIXTURE |
logP: | 2.0265 |
logD: | 1.9572 |
logSw: | -2.9983 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 91.157 |
InChI Key: | KRLJHMHSTFMHJQ-CQSZACIVSA-N |