N-{4-[(4-chlorophenyl)carbamoyl]phenyl}-2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxamide
Chemical Structure Depiction of
N-{4-[(4-chlorophenyl)carbamoyl]phenyl}-2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxamide
N-{4-[(4-chlorophenyl)carbamoyl]phenyl}-2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxamide
Compound characteristics
| Compound ID: | E532-1501 |
| Compound Name: | N-{4-[(4-chlorophenyl)carbamoyl]phenyl}-2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxamide |
| Molecular Weight: | 388.87 |
| Molecular Formula: | C19 H17 Cl N2 O3 S |
| Smiles: | CC1=C(C(Nc2ccc(cc2)C(Nc2ccc(cc2)[Cl])=O)=O)SCCO1 |
| Stereo: | ACHIRAL |
| logP: | 3.1533 |
| logD: | 2.844 |
| logSw: | -3.6159 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 54.691 |
| InChI Key: | NOUUPFGOYSRRHD-UHFFFAOYSA-N |