methyl 5-{[(4-methylphenyl)methyl]carbamamido}-3-propoxy-1-benzothiophene-2-carboxylate
Chemical Structure Depiction of
methyl 5-{[(4-methylphenyl)methyl]carbamamido}-3-propoxy-1-benzothiophene-2-carboxylate
methyl 5-{[(4-methylphenyl)methyl]carbamamido}-3-propoxy-1-benzothiophene-2-carboxylate
Compound characteristics
| Compound ID: | L311-0145 |
| Compound Name: | methyl 5-{[(4-methylphenyl)methyl]carbamamido}-3-propoxy-1-benzothiophene-2-carboxylate |
| Molecular Weight: | 412.51 |
| Molecular Formula: | C22 H24 N2 O4 S |
| Smiles: | CCCOc1c2cc(ccc2sc1C(=O)OC)NC(NCc1ccc(C)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0983 |
| logD: | 5.0983 |
| logSw: | -4.959 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.375 |
| InChI Key: | BDANZMVHXBPDKB-UHFFFAOYSA-N |