![3,4-Dihydro-2'H,11bH-spiro[phthalazino[2,1-a][3,1]benzoxazine-13,5'-pyrimidine]-1,2',4',6'(1'H,2H,3'H)-tetrone structure](/static/products/893/89376-99-8.png)
3,4-Dihydro-2'H,11bH-spiro[phthalazino[2,1-a][3,1]benzoxazine-13,5'-pyrimidine]-1,2',4',6'(1'H,2H,3'H)-tetrone
TL;DR: 3,4-Dihydro-2'H,11bH-spiro[phthalazino[2,1-a][3,1]benzoxazine-13,5'-pyrimidine]-1,2',4',6'(1'H,2H,3'H)-tetrone (CAS 89376-99-8) is a chemical compound with molecular formula C18H14N4O5 and molecular weight 366.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
spiro[1,3-diazinane-5,13'-2,3,4,11b-tetrahydrophthalazino[2,1-a][3,1]benzoxazine]-1',2,4,6-tetrone
Also Known As: 3,4-Dihydro-2'H,11bH-spiro[phthalazino[2,1-a][3,1]benzoxazine-13,5'-pyrimidine]-1,2',4',6'(1'H,2H,3'H)-tetrone, 3',4'-Dihydro-11'bH-spiro[[1,3]diazinane-5,13'-phthalazino[2,1-a][3,1]benzoxazine]-1',2,4,6(2'H)-tetrone, spiro[1,3-diazinane-5,13'-2,3,4,11b-tetrahydrophthalazino[2,1-a][3,1]benzoxazine]-1',2,4,6-tetrone
| Molecular Formula | C18H14N4O5 |
|---|---|
| Molecular Weight | 366.10 g/mol |
| LogP | 0.0 |
| Topological Polar Surface Area | 117.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 0 |
| Exact Mass | 366.0964 |
| Heavy Atoms | 27 |
| Complexity | 812.0 |
Chemical Identifiers
| CAS Number | 89376-99-8 |
|---|---|
| SMILES | C1CC2=C(C(=O)C1)C3(C(=O)NC(=O)NC3=O)OC4N2N=CC5=CC=CC=C45 |
| InChIKey | WVSCLCFUDGMUOW-UHFFFAOYSA-N |
Product Overview
3,4-Dihydro-2'H,11bH-spiro[phthalazino[2,1-a][3,1]benzoxazine-13,5'-pyrimidine]-1,2',4',6'(1'H,2H,3'H)-tetrone (CAS 89376-99-8), with molecular formula C18H14N4O5 and molecular weight 366.10 g/mol. IUPAC: spiro[1,3-diazinane-5,13'-2,3,4,11b-tetrahydrophthalazino[2,1-a][3,1]benzoxazine]-1',2,4,6-tetrone.
Chemical Property Profile of 3,4-Dihydro-2'H,11bH-spiro[phthalazino[2,1-a][3,1]benzoxazine-13,5'-pyrimidine]-1,2',4',6'(1'H,2H,3'H)-tetrone
Property Insights of 3,4-Dihydro-2'H,11bH-spiro[phthalazino[2,1-a][3,1]benzoxazine-13,5'-pyrimidine]-1,2',4',6'(1'H,2H,3'H)-tetrone
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,4-Dihydro-2'H,11bH-spiro[phthalazino[2,1-a][3,1]benzoxazine-13,5'-pyrimidine]-1,2',4',6'(1'H,2H,3'H)-tetrone. The TPSA of 117.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,4-Dihydro-2'H,11bH-spiro[phthalazino[2,1-a][3,1]benzoxazine-13,5'-pyrimidine]-1,2',4',6'(1'H,2H,3'H)-tetrone. Following Lipinski's Rule of Five, 3,4-Dihydro-2'H,11bH-spiro[phthalazino[2,1-a][3,1]benzoxazine-13,5'-pyrimidine]-1,2',4',6'(1'H,2H,3'H)-tetrone has 2 hydrogen bond donor(s) and 7 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 3,4-Dihydro-2'H,11bH-spiro[phthalazino[2,1-a][3,1]benzoxazine-13,5'-pyrimidine]-1,2',4',6'(1'H,2H,3'H)-tetrone?
The CAS number of 3,4-Dihydro-2'H,11bH-spiro[phthalazino[2,1-a][3,1]benzoxazine-13,5'-pyrimidine]-1,2',4',6'(1'H,2H,3'H)-tetrone is 89376-99-8.
What is the molecular formula of 3,4-Dihydro-2'H,11bH-spiro[phthalazino[2,1-a][3,1]benzoxazine-13,5'-pyrimidine]-1,2',4',6'(1'H,2H,3'H)-tetrone?
The molecular formula of 3,4-Dihydro-2'H,11bH-spiro[phthalazino[2,1-a][3,1]benzoxazine-13,5'-pyrimidine]-1,2',4',6'(1'H,2H,3'H)-tetrone is C18H14N4O5.
What is the molecular weight of 3,4-Dihydro-2'H,11bH-spiro[phthalazino[2,1-a][3,1]benzoxazine-13,5'-pyrimidine]-1,2',4',6'(1'H,2H,3'H)-tetrone?
The molecular weight of 3,4-Dihydro-2'H,11bH-spiro[phthalazino[2,1-a][3,1]benzoxazine-13,5'-pyrimidine]-1,2',4',6'(1'H,2H,3'H)-tetrone is 366.10 g/mol.
Where can I buy 3,4-Dihydro-2'H,11bH-spiro[phthalazino[2,1-a][3,1]benzoxazine-13,5'-pyrimidine]-1,2',4',6'(1'H,2H,3'H)-tetrone?
You can request a quote for 3,4-Dihydro-2'H,11bH-spiro[phthalazino[2,1-a][3,1]benzoxazine-13,5'-pyrimidine]-1,2',4',6'(1'H,2H,3'H)-tetrone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4-Dihydro-2'H,11bH-spiro[phthalazino[2,1-a][3,1]benzoxazine-13,5'-pyrimidine]-1,2',4',6'(1'H,2H,3'H)-tetrone?
Yes, KEHONG BIO provides custom synthesis services for 3,4-Dihydro-2'H,11bH-spiro[phthalazino[2,1-a][3,1]benzoxazine-13,5'-pyrimidine]-1,2',4',6'(1'H,2H,3'H)-tetrone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.