ethyl 2-(2-{[2-(pyrrolidin-1-yl)[1,3]thiazolo[4,5-d]pyrimidin-7-yl]sulfanyl}acetamido)benzoate
Chemical Structure Depiction of
ethyl 2-(2-{[2-(pyrrolidin-1-yl)[1,3]thiazolo[4,5-d]pyrimidin-7-yl]sulfanyl}acetamido)benzoate
ethyl 2-(2-{[2-(pyrrolidin-1-yl)[1,3]thiazolo[4,5-d]pyrimidin-7-yl]sulfanyl}acetamido)benzoate
Compound characteristics
| Compound ID: | F813-2361 |
| Compound Name: | ethyl 2-(2-{[2-(pyrrolidin-1-yl)[1,3]thiazolo[4,5-d]pyrimidin-7-yl]sulfanyl}acetamido)benzoate |
| Molecular Weight: | 443.55 |
| Molecular Formula: | C20 H21 N5 O3 S2 |
| Smiles: | CCOC(c1ccccc1NC(CSc1c2c(ncn1)nc(N1CCCC1)s2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0879 |
| logD: | 4.0724 |
| logSw: | -4.0399 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.794 |
| InChI Key: | VYQSIWXHTSNGEK-UHFFFAOYSA-N |