N-(2-{[(2H-1,3-benzodioxol-5-yl)methyl][(thiophen-2-yl)methyl]amino}-2-oxoethyl)-2,4-dichloro-N-[(oxolan-2-yl)methyl]benzamide
Chemical Structure Depiction of
N-(2-{[(2H-1,3-benzodioxol-5-yl)methyl][(thiophen-2-yl)methyl]amino}-2-oxoethyl)-2,4-dichloro-N-[(oxolan-2-yl)methyl]benzamide
N-(2-{[(2H-1,3-benzodioxol-5-yl)methyl][(thiophen-2-yl)methyl]amino}-2-oxoethyl)-2,4-dichloro-N-[(oxolan-2-yl)methyl]benzamide
Compound characteristics
| Compound ID: | V013-8658 |
| Compound Name: | N-(2-{[(2H-1,3-benzodioxol-5-yl)methyl][(thiophen-2-yl)methyl]amino}-2-oxoethyl)-2,4-dichloro-N-[(oxolan-2-yl)methyl]benzamide |
| Molecular Weight: | 561.48 |
| Molecular Formula: | C27 H26 Cl2 N2 O5 S |
| Smiles: | C1CC(CN(CC(N(Cc2ccc3c(c2)OCO3)Cc2cccs2)=O)C(c2ccc(cc2[Cl])[Cl])=O)OC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.437 |
| logD: | 4.437 |
| logSw: | -4.7148 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 58.65 |
| InChI Key: | DDTCSDFXMPINDV-HXUWFJFHSA-N |