BAS 01129988
TL;DR: BAS 01129988 (CAS 332117-39-2) is a chemical compound with molecular formula C15H14BrN5O3 and molecular weight 391.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-bromophenyl)-2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetamide
Also Known As: BAS 01129988, AB01294332-01, N-(4-bromophenyl)-2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetamide, N-(4-bromophenyl)-2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetamide, N-(4-bromophenyl)-2-(1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-7-yl)acetamide
| Molecular Formula | C15H14BrN5O3 |
|---|---|
| Molecular Weight | 391.03 g/mol |
| LogP | 0.8349 |
| Topological Polar Surface Area | 90.92 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 391.028 |
| Heavy Atoms | 24 |
| Complexity | 1045.8872 |
Chemical Identifiers
| CAS Number | 332117-39-2 |
|---|---|
| SMILES | CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC(=O)NC3=CC=C(C=C3)Br |
Product Overview
BAS 01129988 (CAS 332117-39-2), with molecular formula C15H14BrN5O3 and molecular weight 391.03 g/mol. IUPAC: N-(4-bromophenyl)-2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetamide.
Chemical Property Profile of BAS 01129988
Property Insights of BAS 01129988
The XLogP value of 0.8349 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 01129988. The TPSA of 90.92 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01129988. Following Lipinski's Rule of Five, BAS 01129988 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 01129988?
The CAS number of BAS 01129988 is 332117-39-2.
What is the molecular formula of BAS 01129988?
The molecular formula of BAS 01129988 is C15H14BrN5O3.
What is the molecular weight of BAS 01129988?
The molecular weight of BAS 01129988 is 391.03 g/mol.
Where can I buy BAS 01129988?
You can request a quote for BAS 01129988 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01129988?
Yes, KEHONG BIO provides custom synthesis services for BAS 01129988 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.