1,3,5-trimethyl-6-{4-[4-(morpholine-4-carbonyl)-2-nitrophenyl]piperazine-1-sulfonyl}-1,3-dihydro-2H-benzimidazol-2-one
Chemical Structure Depiction of
1,3,5-trimethyl-6-{4-[4-(morpholine-4-carbonyl)-2-nitrophenyl]piperazine-1-sulfonyl}-1,3-dihydro-2H-benzimidazol-2-one
1,3,5-trimethyl-6-{4-[4-(morpholine-4-carbonyl)-2-nitrophenyl]piperazine-1-sulfonyl}-1,3-dihydro-2H-benzimidazol-2-one
Compound characteristics
| Compound ID: | 8018-3755 |
| Compound Name: | 1,3,5-trimethyl-6-{4-[4-(morpholine-4-carbonyl)-2-nitrophenyl]piperazine-1-sulfonyl}-1,3-dihydro-2H-benzimidazol-2-one |
| Molecular Weight: | 558.61 |
| Molecular Formula: | C25 H30 N6 O7 S |
| Smiles: | Cc1cc2c(cc1S(N1CCN(CC1)c1ccc(cc1[N+]([O-])=O)C(N1CCOCC1)=O)(=O)=O)N(C)C(N2C)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5219 |
| logD: | 1.5219 |
| logSw: | -2.4091 |
| Hydrogen bond acceptors count: | 14 |
| Polar surface area: | 110.231 |
| InChI Key: | FQHUYDMFDATJKX-UHFFFAOYSA-N |