5-(4-{[2-(5-chloro-1H-indol-3-yl)ethyl]amino}-4-oxobutyl)-N-(4-methoxyphenyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-(4-{[2-(5-chloro-1H-indol-3-yl)ethyl]amino}-4-oxobutyl)-N-(4-methoxyphenyl)-1,3,4-thiadiazole-2-carboxamide
5-(4-{[2-(5-chloro-1H-indol-3-yl)ethyl]amino}-4-oxobutyl)-N-(4-methoxyphenyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
Compound ID: | F501-0149 |
Compound Name: | 5-(4-{[2-(5-chloro-1H-indol-3-yl)ethyl]amino}-4-oxobutyl)-N-(4-methoxyphenyl)-1,3,4-thiadiazole-2-carboxamide |
Molecular Weight: | 498 |
Molecular Formula: | C24 H24 Cl N5 O3 S |
Smiles: | COc1ccc(cc1)NC(c1nnc(CCCC(NCCc2c[nH]c3ccc(cc23)[Cl])=O)s1)=O |
Stereo: | ACHIRAL |
logP: | 3.6089 |
logD: | 3.6088 |
logSw: | -4.163 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 88.785 |
InChI Key: | SMYGZBQJBAHPLS-UHFFFAOYSA-N |