N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-({[(4-tert-butylphenyl)methyl][2-(3,4-dimethoxyphenyl)ethyl]amino}methyl)-1,3-thiazole-4-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-({[(4-tert-butylphenyl)methyl][2-(3,4-dimethoxyphenyl)ethyl]amino}methyl)-1,3-thiazole-4-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-({[(4-tert-butylphenyl)methyl][2-(3,4-dimethoxyphenyl)ethyl]amino}methyl)-1,3-thiazole-4-carboxamide
Compound characteristics
| Compound ID: | V020-9263 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-({[(4-tert-butylphenyl)methyl][2-(3,4-dimethoxyphenyl)ethyl]amino}methyl)-1,3-thiazole-4-carboxamide |
| Molecular Weight: | 601.77 |
| Molecular Formula: | C34 H39 N3 O5 S |
| Salt: | not_available |
| Smiles: | CC(C)(C)c1ccc(CN(CCc2ccc(c(c2)OC)OC)Cc2nc(cs2)C(NCc2ccc3c(c2)OCO3)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 6.5654 |
| logD: | 6.5652 |
| logSw: | -5.594 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.947 |
| InChI Key: | NLGUTAPTEIXTJA-UHFFFAOYSA-N |