1,3,6-trimethyl-5-{4-[4-(propan-2-yl)benzene-1-sulfonyl]piperazin-1-yl}pyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
1,3,6-trimethyl-5-{4-[4-(propan-2-yl)benzene-1-sulfonyl]piperazin-1-yl}pyrimidine-2,4(1H,3H)-dione
1,3,6-trimethyl-5-{4-[4-(propan-2-yl)benzene-1-sulfonyl]piperazin-1-yl}pyrimidine-2,4(1H,3H)-dione
Compound characteristics
Compound ID: | F669-0053 |
Compound Name: | 1,3,6-trimethyl-5-{4-[4-(propan-2-yl)benzene-1-sulfonyl]piperazin-1-yl}pyrimidine-2,4(1H,3H)-dione |
Molecular Weight: | 420.53 |
Molecular Formula: | C20 H28 N4 O4 S |
Smiles: | CC(C)c1ccc(cc1)S(N1CCN(CC1)C1=C(C)N(C)C(N(C)C1=O)=O)(=O)=O |
Stereo: | ACHIRAL |
logP: | 2.9392 |
logD: | 2.9391 |
logSw: | -3.2429 |
Hydrogen bond acceptors count: | 9 |
Polar surface area: | 66.732 |
InChI Key: | UJAIESHYTFGHOL-UHFFFAOYSA-N |