N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetamide
Chemical Structure Depiction of
N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetamide
N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetamide
Compound characteristics
Compound ID: | 5628-0670 |
Compound Name: | N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetamide |
Molecular Weight: | 403.46 |
Molecular Formula: | C17 H21 N7 O3 S |
Smiles: | CN1C(c2c(ncn2CC(Nc2nnc(C3CCCCC3)s2)=O)N(C)C1=O)=O |
Stereo: | ACHIRAL |
logP: | 1.9766 |
logD: | 1.9017 |
logSw: | -2.4999 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 89.575 |
InChI Key: | QNBORYCUOZBOOU-UHFFFAOYSA-N |