methyl (6-oxo-2-{N'-[4-(propan-2-yl)phenyl]carbamimidamido}-3,6-dihydropyrimidin-4-yl)acetate
Chemical Structure Depiction of
methyl (6-oxo-2-{N'-[4-(propan-2-yl)phenyl]carbamimidamido}-3,6-dihydropyrimidin-4-yl)acetate
methyl (6-oxo-2-{N'-[4-(propan-2-yl)phenyl]carbamimidamido}-3,6-dihydropyrimidin-4-yl)acetate
Compound characteristics
| Compound ID: | 6359-0070 |
| Compound Name: | methyl (6-oxo-2-{N'-[4-(propan-2-yl)phenyl]carbamimidamido}-3,6-dihydropyrimidin-4-yl)acetate |
| Molecular Weight: | 343.38 |
| Molecular Formula: | C17 H21 N5 O3 |
| Smiles: | CC(C)c1ccc(cc1)NC(=N)NC1NC(CC(=O)OC)=CC(N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3865 |
| logD: | 0.7868 |
| logSw: | -3.0116 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 93.237 |
| InChI Key: | VXXLOSYSEPGXHI-UHFFFAOYSA-N |