7-[4-(3-methoxyphenyl)piperazine-1-sulfonyl]-4-methylpyrrolo[1,2-d][1,2,4]triazin-1(2H)-one
Chemical Structure Depiction of
7-[4-(3-methoxyphenyl)piperazine-1-sulfonyl]-4-methylpyrrolo[1,2-d][1,2,4]triazin-1(2H)-one
7-[4-(3-methoxyphenyl)piperazine-1-sulfonyl]-4-methylpyrrolo[1,2-d][1,2,4]triazin-1(2H)-one
Compound characteristics
| Compound ID: | P666-1110 |
| Compound Name: | 7-[4-(3-methoxyphenyl)piperazine-1-sulfonyl]-4-methylpyrrolo[1,2-d][1,2,4]triazin-1(2H)-one |
| Molecular Weight: | 403.46 |
| Molecular Formula: | C18 H21 N5 O4 S |
| Smiles: | CC1=NNC(c2cc(cn12)S(N1CCN(CC1)c1cccc(c1)OC)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.546 |
| logD: | 1.5439 |
| logSw: | -2.5758 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.869 |
| InChI Key: | BNHLQRDSXUTRHM-UHFFFAOYSA-N |