AB00671203-01
TL;DR: AB00671203-01 (CAS 847191-25-7) is a chemical compound with molecular formula C18H15N5O3S and molecular weight 381.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-(furan-2-yl)-1,3-dimethyl-5-(pyridin-3-ylmethylsulfanyl)pyrimido[4,5-d]pyrimidine-2,4-dione
Also Known As: AB00671203-01, F0654-1395, 7-(furan-2-yl)-1,3-dimethyl-5-((pyridin-3-ylmethyl)thio)pyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione, 7-(furan-2-yl)-1,3-dimethyl-5-(pyridin-3-ylmethylsulfanyl)pyrimido[4,5-d]pyrimidine-2,4-dione, 7-(furan-2-yl)-1,3-dimethyl-5-{[(pyridin-3-yl)methyl]sulfanyl}-1H,2H,3H,4H-[1,3]diazino[4,5-d]pyrimidine-2,4-dione
| Molecular Formula | C18H15N5O3S |
|---|---|
| Molecular Weight | 381.09 g/mol |
| LogP | 1.9745 |
| Topological Polar Surface Area | 95.81 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 381.08957 |
| Heavy Atoms | 27 |
| Complexity | 1230.07 |
Chemical Identifiers
| CAS Number | 847191-25-7 |
|---|---|
| SMILES | CN1C2=C(C(=NC(=N2)C3=CC=CO3)SCC4=CN=CC=C4)C(=O)N(C1=O)C |
Product Overview
AB00671203-01 (CAS 847191-25-7), with molecular formula C18H15N5O3S and molecular weight 381.09 g/mol. IUPAC: 7-(furan-2-yl)-1,3-dimethyl-5-(pyridin-3-ylmethylsulfanyl)pyrimido[4,5-d]pyrimidine-2,4-dione.
Chemical Property Profile of AB00671203-01
Property Insights of AB00671203-01
The XLogP value of 1.9745 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00671203-01. The TPSA of 95.81 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00671203-01. Following Lipinski's Rule of Five, AB00671203-01 has 0 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 AB00671203-01?
The CAS number of AB00671203-01 is 847191-25-7.
What is the molecular formula of AB00671203-01?
The molecular formula of AB00671203-01 is C18H15N5O3S.
What is the molecular weight of AB00671203-01?
The molecular weight of AB00671203-01 is 381.09 g/mol.
Where can I buy AB00671203-01?
You can request a quote for AB00671203-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00671203-01?
Yes, KEHONG BIO provides custom synthesis services for AB00671203-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.