6'-chloro-2,6-dihydroxy-1',2',3',3a'-tetrahydro-4H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinolin]-4-one
TL;DR: 6'-chloro-2,6-dihydroxy-1',2',3',3a'-tetrahydro-4H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinolin]-4-one (CAS 879475-78-2) is a chemical compound with molecular formula C15H14ClN3O3 and molecular weight 319.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6'-chlorospiro[1,3-diazinane-5,4'-2,3,3a,5-tetrahydro-1H-pyrrolo[1,2-a]quinoline]-2,4,6-trione
Also Known As: 6'-chloro-2,6-dihydroxy-1',2',3',3a'-tetrahydro-4H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinolin]-4-one, 6'-chloro-2',3',3a',5'-tetrahydro-1H,1'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4,6(3H)-trione, 6'-chlorospiro[1,3-diazinane-5,4'-2,3,3a,5-tetrahydro-1H-pyrrolo[1,2-a]quinoline]-2,4,6-trione
| Molecular Formula | C15H14ClN3O3 |
|---|---|
| Molecular Weight | 319.07 g/mol |
| LogP | 1.2173 |
| Topological Polar Surface Area | 78.51 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 319.07236 |
| Heavy Atoms | 22 |
| Complexity | 697.98425 |
Chemical Identifiers
| CAS Number | 879475-78-2 |
|---|---|
| SMILES | C1CC2C3(CC4=C(N2C1)C=CC=C4Cl)C(=O)NC(=O)NC3=O |
Product Overview
6'-chloro-2,6-dihydroxy-1',2',3',3a'-tetrahydro-4H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinolin]-4-one (CAS 879475-78-2), with molecular formula C15H14ClN3O3 and molecular weight 319.07 g/mol. IUPAC: 6'-chlorospiro[1,3-diazinane-5,4'-2,3,3a,5-tetrahydro-1H-pyrrolo[1,2-a]quinoline]-2,4,6-trione.
Chemical Property Profile of 6'-chloro-2,6-dihydroxy-1',2',3',3a'-tetrahydro-4H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinolin]-4-one
Property Insights of 6'-chloro-2,6-dihydroxy-1',2',3',3a'-tetrahydro-4H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinolin]-4-one
The XLogP value of 1.2173 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6'-chloro-2,6-dihydroxy-1',2',3',3a'-tetrahydro-4H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinolin]-4-one. The TPSA of 78.51 Ų falls within the moderate polarity range, balancing permeability and solubility for 6'-chloro-2,6-dihydroxy-1',2',3',3a'-tetrahydro-4H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinolin]-4-one. Following Lipinski's Rule of Five, 6'-chloro-2,6-dihydroxy-1',2',3',3a'-tetrahydro-4H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinolin]-4-one has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 6'-chloro-2,6-dihydroxy-1',2',3',3a'-tetrahydro-4H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinolin]-4-one?
The CAS number of 6'-chloro-2,6-dihydroxy-1',2',3',3a'-tetrahydro-4H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinolin]-4-one is 879475-78-2.
What is the molecular formula of 6'-chloro-2,6-dihydroxy-1',2',3',3a'-tetrahydro-4H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinolin]-4-one?
The molecular formula of 6'-chloro-2,6-dihydroxy-1',2',3',3a'-tetrahydro-4H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinolin]-4-one is C15H14ClN3O3.
What is the molecular weight of 6'-chloro-2,6-dihydroxy-1',2',3',3a'-tetrahydro-4H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinolin]-4-one?
The molecular weight of 6'-chloro-2,6-dihydroxy-1',2',3',3a'-tetrahydro-4H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinolin]-4-one is 319.07 g/mol.
Where can I buy 6'-chloro-2,6-dihydroxy-1',2',3',3a'-tetrahydro-4H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinolin]-4-one?
You can request a quote for 6'-chloro-2,6-dihydroxy-1',2',3',3a'-tetrahydro-4H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinolin]-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6'-chloro-2,6-dihydroxy-1',2',3',3a'-tetrahydro-4H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinolin]-4-one?
Yes, KEHONG BIO provides custom synthesis services for 6'-chloro-2,6-dihydroxy-1',2',3',3a'-tetrahydro-4H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinolin]-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.