2,6-dimethyl-7-[4-(phenoxyacetyl)piperazine-1-sulfonyl]-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
2,6-dimethyl-7-[4-(phenoxyacetyl)piperazine-1-sulfonyl]-2H-1,4-benzoxazin-3(4H)-one
2,6-dimethyl-7-[4-(phenoxyacetyl)piperazine-1-sulfonyl]-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | F536-0423 |
| Compound Name: | 2,6-dimethyl-7-[4-(phenoxyacetyl)piperazine-1-sulfonyl]-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 459.52 |
| Molecular Formula: | C22 H25 N3 O6 S |
| Smiles: | CC1C(Nc2cc(C)c(cc2O1)S(N1CCN(CC1)C(COc1ccccc1)=O)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.5318 |
| logD: | 1.5312 |
| logSw: | -2.5964 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.986 |
| InChI Key: | XUDUFNHGCALJTL-MRXNPFEDSA-N |