N-{2-methyl-5-[(prop-2-en-1-yl)carbamoyl]phenyl}-5,6-dihydro-1,4-oxathiine-2-carboxamide
Chemical Structure Depiction of
N-{2-methyl-5-[(prop-2-en-1-yl)carbamoyl]phenyl}-5,6-dihydro-1,4-oxathiine-2-carboxamide
N-{2-methyl-5-[(prop-2-en-1-yl)carbamoyl]phenyl}-5,6-dihydro-1,4-oxathiine-2-carboxamide
Compound characteristics
| Compound ID: | G370-1511 |
| Compound Name: | N-{2-methyl-5-[(prop-2-en-1-yl)carbamoyl]phenyl}-5,6-dihydro-1,4-oxathiine-2-carboxamide |
| Molecular Weight: | 318.39 |
| Molecular Formula: | C16 H18 N2 O3 S |
| Smiles: | Cc1ccc(cc1NC(C1=CSCCO1)=O)C(NCC=C)=O |
| Stereo: | ACHIRAL |
| logP: | 1.4745 |
| logD: | 1.4693 |
| logSw: | -2.3997 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.787 |
| InChI Key: | LSQBHTPCWSVLSE-UHFFFAOYSA-N |