3-(4-chlorobenzene-1-sulfonyl)-2-imino-8-methyl-1-[(oxolan-2-yl)methyl]-1,2-dihydro-5H-dipyrido[1,2-a:2',3'-d]pyrimidin-5-one
Chemical Structure Depiction of
3-(4-chlorobenzene-1-sulfonyl)-2-imino-8-methyl-1-[(oxolan-2-yl)methyl]-1,2-dihydro-5H-dipyrido[1,2-a:2',3'-d]pyrimidin-5-one
3-(4-chlorobenzene-1-sulfonyl)-2-imino-8-methyl-1-[(oxolan-2-yl)methyl]-1,2-dihydro-5H-dipyrido[1,2-a:2',3'-d]pyrimidin-5-one
Compound characteristics
| Compound ID: | 5611-1881 |
| Compound Name: | 3-(4-chlorobenzene-1-sulfonyl)-2-imino-8-methyl-1-[(oxolan-2-yl)methyl]-1,2-dihydro-5H-dipyrido[1,2-a:2',3'-d]pyrimidin-5-one |
| Molecular Weight: | 484.96 |
| Molecular Formula: | C23 H21 Cl N4 O4 S |
| Smiles: | CC1C=CC2=NC3=C(C=C(C(=N)N3CC3CCCO3)S(c3ccc(cc3)[Cl])(=O)=O)C(N2C=1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.3866 |
| logD: | 2.3468 |
| logSw: | -3.354 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.943 |
| InChI Key: | JVPODEADZBCKQE-MRXNPFEDSA-N |