BAS 00732386
TL;DR: BAS 00732386 (CAS 316360-16-4) is a chemical compound with molecular formula C24H19BrN4O4S and molecular weight 538.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,6-diamino-2-(4-bromobenzoyl)-4-(3,4,5-trimethoxyphenyl)thieno[2,3-b]pyridine-5-carbonitrile
Also Known As: BAS 00732386, 3,6-diamino-2-(4-bromobenzoyl)-4-(3,4,5-trimethoxyphenyl)thieno[2,3-b]pyridine-5-carbonitrile, A1874/0078851, 3,6-diamino-2-[(4-bromophenyl)carbonyl]-4-(3,4,5-trimethoxyphenyl)thieno[2,3-b]pyridine-5-carbonitrile
| Molecular Formula | C24H19BrN4O4S |
|---|---|
| Molecular Weight | 538.03 g/mol |
| LogP | 5.01868 |
| Topological Polar Surface Area | 133.48 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 6 |
| Exact Mass | 538.03107 |
| Heavy Atoms | 34 |
| Complexity | 1450.5876 |
Chemical Identifiers
| CAS Number | 316360-16-4 |
|---|---|
| SMILES | COC1=CC(=CC(=C1OC)OC)C2=C(C(=NC3=C2C(=C(S3)C(=O)C4=CC=C(C=C4)Br)N)N)C#N |
Product Overview
BAS 00732386 (CAS 316360-16-4), with molecular formula C24H19BrN4O4S and molecular weight 538.03 g/mol. IUPAC: 3,6-diamino-2-(4-bromobenzoyl)-4-(3,4,5-trimethoxyphenyl)thieno[2,3-b]pyridine-5-carbonitrile.
Chemical Property Profile of BAS 00732386
Property Insights of BAS 00732386
The XLogP value of 5.01868 indicates that BAS 00732386 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 133.48 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00732386. Following Lipinski's Rule of Five, BAS 00732386 has 2 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00732386?
The CAS number of BAS 00732386 is 316360-16-4.
What is the molecular formula of BAS 00732386?
The molecular formula of BAS 00732386 is C24H19BrN4O4S.
What is the molecular weight of BAS 00732386?
The molecular weight of BAS 00732386 is 538.03 g/mol.
Where can I buy BAS 00732386?
You can request a quote for BAS 00732386 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00732386?
Yes, KEHONG BIO provides custom synthesis services for BAS 00732386 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.