methyl 2-chloro-5-methoxy-4-{[(3,4,5-trimethoxybenzoyl)carbamothioyl]amino}benzoate
Chemical Structure Depiction of
methyl 2-chloro-5-methoxy-4-{[(3,4,5-trimethoxybenzoyl)carbamothioyl]amino}benzoate
methyl 2-chloro-5-methoxy-4-{[(3,4,5-trimethoxybenzoyl)carbamothioyl]amino}benzoate
Compound characteristics
| Compound ID: | 1683-6250 |
| Compound Name: | methyl 2-chloro-5-methoxy-4-{[(3,4,5-trimethoxybenzoyl)carbamothioyl]amino}benzoate |
| Molecular Weight: | 468.91 |
| Molecular Formula: | C20 H21 Cl N2 O7 S |
| Smiles: | COC(c1cc(c(cc1[Cl])NC(NC(c1cc(c(c(c1)OC)OC)OC)=O)=S)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0007 |
| logD: | 3.9081 |
| logSw: | -4.5642 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 84.324 |
| InChI Key: | YYFJQODSAOMFII-UHFFFAOYSA-N |