N-[4-(methanesulfonyl)phenyl]-2-[3-oxo-8-(pyrrolidin-1-yl)[1,3]thiazolo[5,4-e][1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]acetamide
Chemical Structure Depiction of
N-[4-(methanesulfonyl)phenyl]-2-[3-oxo-8-(pyrrolidin-1-yl)[1,3]thiazolo[5,4-e][1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]acetamide
N-[4-(methanesulfonyl)phenyl]-2-[3-oxo-8-(pyrrolidin-1-yl)[1,3]thiazolo[5,4-e][1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]acetamide
Compound characteristics
| Compound ID: | M447-0120 |
| Compound Name: | N-[4-(methanesulfonyl)phenyl]-2-[3-oxo-8-(pyrrolidin-1-yl)[1,3]thiazolo[5,4-e][1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]acetamide |
| Molecular Weight: | 473.53 |
| Molecular Formula: | C19 H19 N7 O4 S2 |
| Smiles: | CS(c1ccc(cc1)NC(CN1C(N2C=Nc3c(C2=N1)sc(n3)N1CCCC1)=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.678 |
| logD: | 1.6765 |
| logSw: | -2.5902 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 108.8 |
| InChI Key: | SYBFPPYWFZCMTD-UHFFFAOYSA-N |