2-{[(2,3-dimethoxyphenyl)methyl]sulfanyl}-N-[(furan-2-yl)methyl]-5-(morpholine-4-sulfonyl)benzamide
Chemical Structure Depiction of
2-{[(2,3-dimethoxyphenyl)methyl]sulfanyl}-N-[(furan-2-yl)methyl]-5-(morpholine-4-sulfonyl)benzamide
2-{[(2,3-dimethoxyphenyl)methyl]sulfanyl}-N-[(furan-2-yl)methyl]-5-(morpholine-4-sulfonyl)benzamide
Compound characteristics
| Compound ID: | K834-3512 |
| Compound Name: | 2-{[(2,3-dimethoxyphenyl)methyl]sulfanyl}-N-[(furan-2-yl)methyl]-5-(morpholine-4-sulfonyl)benzamide |
| Molecular Weight: | 532.63 |
| Molecular Formula: | C25 H28 N2 O7 S2 |
| Smiles: | COc1cccc(CSc2ccc(cc2C(NCc2ccco2)=O)S(N2CCOCC2)(=O)=O)c1OC |
| Stereo: | ACHIRAL |
| logP: | 4.0891 |
| logD: | 4.0889 |
| logSw: | -4.1542 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.096 |
| InChI Key: | AUQMYFRBEKGDLT-UHFFFAOYSA-N |