N-butyl-2-({3-[2-(diethylamino)ethyl]-6-(2-methoxyphenyl)-7-oxo-2-sulfanylidene-2,3,6,7-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-5-yl}sulfanyl)acetamide
Chemical Structure Depiction of
N-butyl-2-({3-[2-(diethylamino)ethyl]-6-(2-methoxyphenyl)-7-oxo-2-sulfanylidene-2,3,6,7-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-5-yl}sulfanyl)acetamide
N-butyl-2-({3-[2-(diethylamino)ethyl]-6-(2-methoxyphenyl)-7-oxo-2-sulfanylidene-2,3,6,7-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-5-yl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | K286-3544 |
| Compound Name: | N-butyl-2-({3-[2-(diethylamino)ethyl]-6-(2-methoxyphenyl)-7-oxo-2-sulfanylidene-2,3,6,7-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-5-yl}sulfanyl)acetamide |
| Molecular Weight: | 535.75 |
| Molecular Formula: | C24 H33 N5 O3 S3 |
| Smiles: | CCCCNC(CSC1=NC2=C(C(N1c1ccccc1OC)=O)SC(N2CCN(CC)CC)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6912 |
| logD: | 1.8171 |
| logSw: | -3.921 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.141 |
| InChI Key: | YTIIYDSIMQCKKG-UHFFFAOYSA-N |