ChemDiv3_012274
TL;DR: ChemDiv3_012274 (CAS 876150-96-8) is a chemical compound with molecular formula C17H21N5O3 and molecular weight 343.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-(furan-2-ylmethyl)-1-methyl-3-propyl-7,8-dihydro-6H-purino[7,8-a]pyrimidine-2,4-dione
Also Known As: ChemDiv3_012274, BAS 12521331, F2013-0240, BRD-K51311953-001-01-9, 9-(furan-2-ylmethyl)-1-methyl-3-propyl-7,8-dihydro-6H-purino[7,8-a]pyrimidine-2,4-dione
| Molecular Formula | C17H21N5O3 |
|---|---|
| Molecular Weight | 343.16 g/mol |
| LogP | 1.31 |
| Topological Polar Surface Area | 78.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 343.16443 |
| Heavy Atoms | 25 |
| Complexity | 1025.397 |
Chemical Identifiers
| CAS Number | 876150-96-8 |
|---|---|
| SMILES | CCCN1C(=O)C2=C(N=C3N2CCCN3CC4=CC=CO4)N(C1=O)C |
Product Overview
ChemDiv3_012274 (CAS 876150-96-8), with molecular formula C17H21N5O3 and molecular weight 343.16 g/mol. IUPAC: 9-(furan-2-ylmethyl)-1-methyl-3-propyl-7,8-dihydro-6H-purino[7,8-a]pyrimidine-2,4-dione.
Chemical Property Profile of ChemDiv3_012274
Property Insights of ChemDiv3_012274
The XLogP value of 1.31 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ChemDiv3_012274. The TPSA of 78.2 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv3_012274. Following Lipinski's Rule of Five, ChemDiv3_012274 has 0 hydrogen bond donor(s) and 5 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 ChemDiv3_012274?
The CAS number of ChemDiv3_012274 is 876150-96-8.
What is the molecular formula of ChemDiv3_012274?
The molecular formula of ChemDiv3_012274 is C17H21N5O3.
What is the molecular weight of ChemDiv3_012274?
The molecular weight of ChemDiv3_012274 is 343.16 g/mol.
Where can I buy ChemDiv3_012274?
You can request a quote for ChemDiv3_012274 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv3_012274?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv3_012274 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.