N,N,2-trimethyl-6-[4-(3-nitrobenzene-1-sulfonyl)piperazin-1-yl]pyrimidin-4-amine
Chemical Structure Depiction of
N,N,2-trimethyl-6-[4-(3-nitrobenzene-1-sulfonyl)piperazin-1-yl]pyrimidin-4-amine
N,N,2-trimethyl-6-[4-(3-nitrobenzene-1-sulfonyl)piperazin-1-yl]pyrimidin-4-amine
Compound characteristics
| Compound ID: | D430-1018 |
| Compound Name: | N,N,2-trimethyl-6-[4-(3-nitrobenzene-1-sulfonyl)piperazin-1-yl]pyrimidin-4-amine |
| Molecular Weight: | 406.46 |
| Molecular Formula: | C17 H22 N6 O4 S |
| Smiles: | Cc1nc(cc(n1)N1CCN(CC1)S(c1cccc(c1)[N+]([O-])=O)(=O)=O)N(C)C |
| Stereo: | ACHIRAL |
| logP: | 2.8431 |
| logD: | 1.4877 |
| logSw: | -3.4217 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 88.507 |
| InChI Key: | AGKAWKOGVNPXOP-UHFFFAOYSA-N |