ChemDiv2_006534
TL;DR: ChemDiv2_006534 (CAS 578718-74-8) is a chemical compound with molecular formula C24H26N6O3 and molecular weight 446.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[8-[(dibenzylamino)methyl]-1,3-dimethyl-2,6-dioxopurin-7-yl]acetamide
Also Known As: ChemDiv2_006534, IDI1_005249, AB01301148-01, 2-{8-[(dibenzylamino)methyl]-1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl}acetamide, 2-[8-[(dibenzylamino)methyl]-1,3-dimethyl-2,6-dioxopurin-7-yl]acetamide
| Molecular Formula | C24H26N6O3 |
|---|---|
| Molecular Weight | 446.21 g/mol |
| LogP | 1.1214 |
| Topological Polar Surface Area | 108.15 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 446.20663 |
| Heavy Atoms | 33 |
| Complexity | 1362.1565 |
Chemical Identifiers
| CAS Number | 578718-74-8 |
|---|---|
| SMILES | CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)CN(CC3=CC=CC=C3)CC4=CC=CC=C4)CC(=O)N |
Product Overview
ChemDiv2_006534 (CAS 578718-74-8), with molecular formula C24H26N6O3 and molecular weight 446.21 g/mol. IUPAC: 2-[8-[(dibenzylamino)methyl]-1,3-dimethyl-2,6-dioxopurin-7-yl]acetamide.
Chemical Property Profile of ChemDiv2_006534
Property Insights of ChemDiv2_006534
The XLogP value of 1.1214 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ChemDiv2_006534. The TPSA of 108.15 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv2_006534. Following Lipinski's Rule of Five, ChemDiv2_006534 has 1 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_006534?
The CAS number of ChemDiv2_006534 is 578718-74-8.
What is the molecular formula of ChemDiv2_006534?
The molecular formula of ChemDiv2_006534 is C24H26N6O3.
What is the molecular weight of ChemDiv2_006534?
The molecular weight of ChemDiv2_006534 is 446.21 g/mol.
Where can I buy ChemDiv2_006534?
You can request a quote for ChemDiv2_006534 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv2_006534?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv2_006534 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.