N-(cyclopropylmethyl)-3-{[(4-{[2-(3,4-dimethoxyphenyl)ethyl](methyl)amino}-5,6-dimethylpyrimidin-2-yl)sulfanyl]methyl}benzamide
Chemical Structure Depiction of
N-(cyclopropylmethyl)-3-{[(4-{[2-(3,4-dimethoxyphenyl)ethyl](methyl)amino}-5,6-dimethylpyrimidin-2-yl)sulfanyl]methyl}benzamide
N-(cyclopropylmethyl)-3-{[(4-{[2-(3,4-dimethoxyphenyl)ethyl](methyl)amino}-5,6-dimethylpyrimidin-2-yl)sulfanyl]methyl}benzamide
Compound characteristics
| Compound ID: | V003-4609 |
| Compound Name: | N-(cyclopropylmethyl)-3-{[(4-{[2-(3,4-dimethoxyphenyl)ethyl](methyl)amino}-5,6-dimethylpyrimidin-2-yl)sulfanyl]methyl}benzamide |
| Molecular Weight: | 520.69 |
| Molecular Formula: | C29 H36 N4 O3 S |
| Salt: | not_available |
| Smiles: | Cc1c(C)nc(nc1N(C)CCc1ccc(c(c1)OC)OC)SCc1cccc(c1)C(NCC1CC1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9876 |
| logD: | 4.9679 |
| logSw: | -4.715 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.9 |
| InChI Key: | ZOUIZBJITFRBNN-UHFFFAOYSA-N |