N-(4-oxo-3,4-dihydro-2H-1,3-benzothiazin-2-ylidene)-N'-phenylurea
Chemical Structure Depiction of
N-(4-oxo-3,4-dihydro-2H-1,3-benzothiazin-2-ylidene)-N'-phenylurea
N-(4-oxo-3,4-dihydro-2H-1,3-benzothiazin-2-ylidene)-N'-phenylurea
Compound characteristics
| Compound ID: | 4181-1426 |
| Compound Name: | N-(4-oxo-3,4-dihydro-2H-1,3-benzothiazin-2-ylidene)-N'-phenylurea |
| Molecular Weight: | 297.33 |
| Molecular Formula: | C15 H11 N3 O2 S |
| Smiles: | c1ccc(cc1)NC(/N=C1/NC(c2ccccc2S1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1778 |
| logD: | 1.8249 |
| logSw: | -3.1548 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.177 |
| InChI Key: | XCMJANXGDOQEAB-UHFFFAOYSA-N |