[2-({[(2H-1,3-benzodioxol-5-yl)methyl][(4-tert-butylphenyl)methyl]amino}methyl)-1,3-thiazol-4-yl][4-(4-methoxyphenyl)piperazin-1-yl]methanone
Chemical Structure Depiction of
[2-({[(2H-1,3-benzodioxol-5-yl)methyl][(4-tert-butylphenyl)methyl]amino}methyl)-1,3-thiazol-4-yl][4-(4-methoxyphenyl)piperazin-1-yl]methanone
[2-({[(2H-1,3-benzodioxol-5-yl)methyl][(4-tert-butylphenyl)methyl]amino}methyl)-1,3-thiazol-4-yl][4-(4-methoxyphenyl)piperazin-1-yl]methanone
Compound characteristics
| Compound ID: | V001-4785 |
| Compound Name: | [2-({[(2H-1,3-benzodioxol-5-yl)methyl][(4-tert-butylphenyl)methyl]amino}methyl)-1,3-thiazol-4-yl][4-(4-methoxyphenyl)piperazin-1-yl]methanone |
| Molecular Weight: | 612.79 |
| Molecular Formula: | C35 H40 N4 O4 S |
| Salt: | not_available |
| Smiles: | CC(C)(C)c1ccc(CN(Cc2ccc3c(c2)OCO3)Cc2nc(cs2)C(N2CCN(CC2)c2ccc(cc2)OC)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 6.9724 |
| logD: | 6.9697 |
| logSw: | -5.6422 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 58.747 |
| InChI Key: | WRFYYHAEYIWBBG-UHFFFAOYSA-N |