N-butyl-N-(2-{[2-(3,4-dimethoxyphenyl)ethyl][(5-methylthiophen-2-yl)methyl]amino}-2-oxoethyl)naphthalene-2-carboxamide
Chemical Structure Depiction of
N-butyl-N-(2-{[2-(3,4-dimethoxyphenyl)ethyl][(5-methylthiophen-2-yl)methyl]amino}-2-oxoethyl)naphthalene-2-carboxamide
N-butyl-N-(2-{[2-(3,4-dimethoxyphenyl)ethyl][(5-methylthiophen-2-yl)methyl]amino}-2-oxoethyl)naphthalene-2-carboxamide
Compound characteristics
| Compound ID: | V013-0217 |
| Compound Name: | N-butyl-N-(2-{[2-(3,4-dimethoxyphenyl)ethyl][(5-methylthiophen-2-yl)methyl]amino}-2-oxoethyl)naphthalene-2-carboxamide |
| Molecular Weight: | 558.74 |
| Molecular Formula: | C33 H38 N2 O4 S |
| Smiles: | CCCCN(CC(N(CCc1ccc(c(c1)OC)OC)Cc1ccc(C)s1)=O)C(c1ccc2ccccc2c1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.2076 |
| logD: | 6.2076 |
| logSw: | -6.2839 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 48.097 |
| InChI Key: | SXUBYIKXANSURE-UHFFFAOYSA-N |