ChemDiv2_004724
TL;DR: ChemDiv2_004724 (CAS 342785-98-2) 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.
7-[2-hydroxy-3-(3-methylanilino)propyl]-1,3-dimethylpurine-2,6-dione
Also Known As: ChemDiv2_004724, VEGFR/PDGFR-IN-1, CBKinase1_005098, CBKinase1_017498, IDI1_003439
| Molecular Formula | C17H21N5O3 |
|---|---|
| Molecular Weight | 343.16 g/mol |
| LogP | 0.21512 |
| Topological Polar Surface Area | 94.08 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 343.16443 |
| Heavy Atoms | 25 |
| Complexity | 1030.9198 |
Chemical Identifiers
| CAS Number | 342785-98-2 |
|---|---|
| SMILES | CC1=CC(=CC=C1)NCC(CN2C=NC3=C2C(=O)N(C(=O)N3C)C)O |
Product Overview
ChemDiv2_004724 (CAS 342785-98-2), with molecular formula C17H21N5O3 and molecular weight 343.16 g/mol. IUPAC: 7-[2-hydroxy-3-(3-methylanilino)propyl]-1,3-dimethylpurine-2,6-dione.
Chemical Property Profile of ChemDiv2_004724
Property Insights of ChemDiv2_004724
The XLogP value of 0.21512 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ChemDiv2_004724. The TPSA of 94.08 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv2_004724. Following Lipinski's Rule of Five, ChemDiv2_004724 has 2 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 ChemDiv2_004724?
The CAS number of ChemDiv2_004724 is 342785-98-2.
What is the molecular formula of ChemDiv2_004724?
The molecular formula of ChemDiv2_004724 is C17H21N5O3.
What is the molecular weight of ChemDiv2_004724?
The molecular weight of ChemDiv2_004724 is 343.16 g/mol.
Where can I buy ChemDiv2_004724?
You can request a quote for ChemDiv2_004724 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv2_004724?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv2_004724 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.