7-[4-(4-chlorophenyl)piperazine-1-sulfonyl]-4-methylpyrrolo[1,2-d][1,2,4]triazin-1(2H)-one
Chemical Structure Depiction of
7-[4-(4-chlorophenyl)piperazine-1-sulfonyl]-4-methylpyrrolo[1,2-d][1,2,4]triazin-1(2H)-one
7-[4-(4-chlorophenyl)piperazine-1-sulfonyl]-4-methylpyrrolo[1,2-d][1,2,4]triazin-1(2H)-one
Compound characteristics
| Compound ID: | P666-1096 |
| Compound Name: | 7-[4-(4-chlorophenyl)piperazine-1-sulfonyl]-4-methylpyrrolo[1,2-d][1,2,4]triazin-1(2H)-one |
| Molecular Weight: | 407.88 |
| Molecular Formula: | C17 H18 Cl N5 O3 S |
| Smiles: | CC1=NNC(c2cc(cn12)S(N1CCN(CC1)c1ccc(cc1)[Cl])(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1543 |
| logD: | 2.1522 |
| logSw: | -3.194 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.326 |
| InChI Key: | LAKXQAPFSPKCKK-UHFFFAOYSA-N |