BAS 01279514
TL;DR: BAS 01279514 (CAS 312757-84-9) is a chemical compound with molecular formula C28H22BrN3O3S and molecular weight 559.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-bromophenyl)-2-[[3-cyano-4,6-bis(4-methoxyphenyl)-2-pyridinyl]sulfanyl]acetamide
Also Known As: BAS 01279514, AE-848/08502009, N-(4-bromophenyl)-2-[3-cyano-4,6-bis(4-methoxyphenyl)pyridin-2-yl]sulfanylacetamide, N-(4-bromophenyl)-2-{[3-cyano-4,6-bis(4-methoxyphenyl)pyridin-2-yl]sulfanyl}acetamide, N-(4-bromophenyl)-2-((3-cyano-4,6-bis(4-methoxyphenyl)pyridin-2-yl)thio)acetamide
| Molecular Formula | C28H22BrN3O3S |
|---|---|
| Molecular Weight | 559.06 g/mol |
| LogP | 6.79778 |
| Topological Polar Surface Area | 84.24 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 559.0565 |
| Heavy Atoms | 36 |
| Complexity | 1400.6515 |
Chemical Identifiers
| CAS Number | 312757-84-9 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2=CC(=NC(=C2C#N)SCC(=O)NC3=CC=C(C=C3)Br)C4=CC=C(C=C4)OC |
Product Overview
BAS 01279514 (CAS 312757-84-9), with molecular formula C28H22BrN3O3S and molecular weight 559.06 g/mol. IUPAC: N-(4-bromophenyl)-2-[[3-cyano-4,6-bis(4-methoxyphenyl)-2-pyridinyl]sulfanyl]acetamide.
Chemical Property Profile of BAS 01279514
Property Insights of BAS 01279514
The XLogP value of 6.79778 indicates that BAS 01279514 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.24 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01279514. Following Lipinski's Rule of Five, BAS 01279514 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 01279514?
The CAS number of BAS 01279514 is 312757-84-9.
What is the molecular formula of BAS 01279514?
The molecular formula of BAS 01279514 is C28H22BrN3O3S.
What is the molecular weight of BAS 01279514?
The molecular weight of BAS 01279514 is 559.06 g/mol.
Where can I buy BAS 01279514?
You can request a quote for BAS 01279514 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01279514?
Yes, KEHONG BIO provides custom synthesis services for BAS 01279514 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.