BAS 01129927
TL;DR: BAS 01129927 (CAS 349400-52-8) is a chemical compound with molecular formula C15H14IN5O3 and molecular weight 439.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1,3-dimethyl-2,6-dioxopurin-7-yl)-N-(4-iodophenyl)acetamide
Also Known As: BAS 01129927, UPCMLD0ENAT5701863:001, 2-(1,3-dimethyl-2,6-dioxopurin-7-yl)-N-(4-iodophenyl)acetamide, 2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)-N-(4-iodophenyl)acetamide, 2-(1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-7-yl)-N-(4-iodophenyl)acetamide
| Molecular Formula | C15H14IN5O3 |
|---|---|
| Molecular Weight | 439.01 g/mol |
| LogP | 0.677 |
| Topological Polar Surface Area | 90.92 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 439.01413 |
| Heavy Atoms | 24 |
| Complexity | 1045.8872 |
Chemical Identifiers
| CAS Number | 349400-52-8 |
|---|---|
| SMILES | CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC(=O)NC3=CC=C(C=C3)I |
Product Overview
BAS 01129927 (CAS 349400-52-8), with molecular formula C15H14IN5O3 and molecular weight 439.01 g/mol. IUPAC: 2-(1,3-dimethyl-2,6-dioxopurin-7-yl)-N-(4-iodophenyl)acetamide.
Chemical Property Profile of BAS 01129927
Property Insights of BAS 01129927
The XLogP value of 0.677 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 01129927. The TPSA of 90.92 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01129927. Following Lipinski's Rule of Five, BAS 01129927 has 1 hydrogen bond donor(s) and 4 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 BAS 01129927?
The CAS number of BAS 01129927 is 349400-52-8.
What is the molecular formula of BAS 01129927?
The molecular formula of BAS 01129927 is C15H14IN5O3.
What is the molecular weight of BAS 01129927?
The molecular weight of BAS 01129927 is 439.01 g/mol.
Where can I buy BAS 01129927?
You can request a quote for BAS 01129927 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01129927?
Yes, KEHONG BIO provides custom synthesis services for BAS 01129927 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.