[4-(3-chloro-6-nitro-1-benzothiophene-2-carbonyl)piperazin-1-yl](5-methyl-1,2-oxazol-3-yl)methanone
Chemical Structure Depiction of
[4-(3-chloro-6-nitro-1-benzothiophene-2-carbonyl)piperazin-1-yl](5-methyl-1,2-oxazol-3-yl)methanone
[4-(3-chloro-6-nitro-1-benzothiophene-2-carbonyl)piperazin-1-yl](5-methyl-1,2-oxazol-3-yl)methanone
Compound characteristics
| Compound ID: | Y205-4178 |
| Compound Name: | [4-(3-chloro-6-nitro-1-benzothiophene-2-carbonyl)piperazin-1-yl](5-methyl-1,2-oxazol-3-yl)methanone |
| Molecular Weight: | 434.86 |
| Molecular Formula: | C18 H15 Cl N4 O5 S |
| Smiles: | Cc1cc(C(N2CCN(CC2)C(c2c(c3ccc(cc3s2)[N+]([O-])=O)[Cl])=O)=O)no1 |
| Stereo: | ACHIRAL |
| logP: | 3.4593 |
| logD: | 3.4593 |
| logSw: | -4.2587 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 88.7 |
| InChI Key: | RAPNVKMOXCSAIZ-UHFFFAOYSA-N |