N-[1-(5-ethyl-4-methyl-6-oxo-1,6-dihydropyrimidin-2-yl)-3-methyl-1H-pyrazol-5-yl]-4-(pyrrolidine-1-sulfonyl)benzamide--hydrogen chloride (1/1)
Chemical Structure Depiction of
N-[1-(5-ethyl-4-methyl-6-oxo-1,6-dihydropyrimidin-2-yl)-3-methyl-1H-pyrazol-5-yl]-4-(pyrrolidine-1-sulfonyl)benzamide--hydrogen chloride (1/1)
N-[1-(5-ethyl-4-methyl-6-oxo-1,6-dihydropyrimidin-2-yl)-3-methyl-1H-pyrazol-5-yl]-4-(pyrrolidine-1-sulfonyl)benzamide--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | F269-0582 |
| Compound Name: | N-[1-(5-ethyl-4-methyl-6-oxo-1,6-dihydropyrimidin-2-yl)-3-methyl-1H-pyrazol-5-yl]-4-(pyrrolidine-1-sulfonyl)benzamide--hydrogen chloride (1/1) |
| Molecular Weight: | 507.01 |
| Molecular Formula: | C22 H26 N6 O4 S |
| Salt: | HCl |
| Smiles: | CCC1=C(C)N=C(NC1=O)n1c(cc(C)n1)NC(c1ccc(cc1)S(N1CCCC1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7162 |
| logD: | 1.0644 |
| logSw: | -2.6817 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 103.565 |
| InChI Key: | VNOSONVCULJTHU-UHFFFAOYSA-N |