2-({[(2H-1,3-benzodioxol-5-yl)methyl][2-(3,4-dimethoxyphenyl)ethyl]amino}methyl)-N-(diphenylmethyl)-1,3-thiazole-4-carboxamide
Chemical Structure Depiction of
2-({[(2H-1,3-benzodioxol-5-yl)methyl][2-(3,4-dimethoxyphenyl)ethyl]amino}methyl)-N-(diphenylmethyl)-1,3-thiazole-4-carboxamide
2-({[(2H-1,3-benzodioxol-5-yl)methyl][2-(3,4-dimethoxyphenyl)ethyl]amino}methyl)-N-(diphenylmethyl)-1,3-thiazole-4-carboxamide
Compound characteristics
| Compound ID: | V018-6066 |
| Compound Name: | 2-({[(2H-1,3-benzodioxol-5-yl)methyl][2-(3,4-dimethoxyphenyl)ethyl]amino}methyl)-N-(diphenylmethyl)-1,3-thiazole-4-carboxamide |
| Molecular Weight: | 621.76 |
| Molecular Formula: | C36 H35 N3 O5 S |
| Salt: | not_available |
| Smiles: | COc1ccc(CCN(Cc2ccc3c(c2)OCO3)Cc2nc(cs2)C(NC(c2ccccc2)c2ccccc2)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 6.1952 |
| logD: | 6.1939 |
| logSw: | -5.4542 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.028 |
| InChI Key: | QSXDVBMAWUCIQK-UHFFFAOYSA-N |