N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(4-fluorophenyl)sulfanyl]-5-(morpholine-4-sulfonyl)benzamide
Chemical Structure Depiction of
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(4-fluorophenyl)sulfanyl]-5-(morpholine-4-sulfonyl)benzamide
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(4-fluorophenyl)sulfanyl]-5-(morpholine-4-sulfonyl)benzamide
Compound characteristics
| Compound ID: | K834-3721 |
| Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(4-fluorophenyl)sulfanyl]-5-(morpholine-4-sulfonyl)benzamide |
| Molecular Weight: | 560.66 |
| Molecular Formula: | C27 H29 F N2 O6 S2 |
| Smiles: | COc1ccc(CCNC(c2cc(ccc2Sc2ccc(cc2)F)S(N2CCOCC2)(=O)=O)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 3.96 |
| logD: | 3.9599 |
| logSw: | -4.0777 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.102 |
| InChI Key: | AMZGSSRDMLLTOG-UHFFFAOYSA-N |