N-{5-chloro-2-[(1,2,3,4-tetrahydronaphthalen-1-yl)carbamoyl]phenyl}-2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxamide
Chemical Structure Depiction of
N-{5-chloro-2-[(1,2,3,4-tetrahydronaphthalen-1-yl)carbamoyl]phenyl}-2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxamide
N-{5-chloro-2-[(1,2,3,4-tetrahydronaphthalen-1-yl)carbamoyl]phenyl}-2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxamide
Compound characteristics
| Compound ID: | E532-0712 |
| Compound Name: | N-{5-chloro-2-[(1,2,3,4-tetrahydronaphthalen-1-yl)carbamoyl]phenyl}-2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxamide |
| Molecular Weight: | 442.96 |
| Molecular Formula: | C23 H23 Cl N2 O3 S |
| Smiles: | CC1=C(C(Nc2cc(ccc2C(NC2CCCc3ccccc23)=O)[Cl])=O)SCCO1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9488 |
| logD: | 2.1239 |
| logSw: | -4.3656 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 55.16 |
| InChI Key: | PHDWTSTWBUOBNJ-IBGZPJMESA-N |