methyl 4-[({3-[(5-chloro-2-methoxyphenyl)carbamoyl]-4-fluorobenzene-1-sulfonyl}[(3,4-dimethoxyphenyl)methyl]amino)methyl]benzoate
Chemical Structure Depiction of
methyl 4-[({3-[(5-chloro-2-methoxyphenyl)carbamoyl]-4-fluorobenzene-1-sulfonyl}[(3,4-dimethoxyphenyl)methyl]amino)methyl]benzoate
methyl 4-[({3-[(5-chloro-2-methoxyphenyl)carbamoyl]-4-fluorobenzene-1-sulfonyl}[(3,4-dimethoxyphenyl)methyl]amino)methyl]benzoate
Compound characteristics
| Compound ID: | K783-3668 |
| Compound Name: | methyl 4-[({3-[(5-chloro-2-methoxyphenyl)carbamoyl]-4-fluorobenzene-1-sulfonyl}[(3,4-dimethoxyphenyl)methyl]amino)methyl]benzoate |
| Molecular Weight: | 657.11 |
| Molecular Formula: | C32 H30 Cl F N2 O8 S |
| Smiles: | COC(c1ccc(CN(Cc2ccc(c(c2)OC)OC)S(c2ccc(c(c2)C(Nc2cc(ccc2OC)[Cl])=O)F)(=O)=O)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.8855 |
| logD: | 4.7407 |
| logSw: | -5.9963 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 97.801 |
| InChI Key: | MUUVBIGSAAEXPC-UHFFFAOYSA-N |