2-(1,3-benzoxazol-2-ylsulfanyl)-N-(5-chloropyridin-2-yl)butanamide
TL;DR: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-(5-chloropyridin-2-yl)butanamide (CAS 389083-70-9) is a chemical compound with molecular formula C16H14ClN3O2S and molecular weight 347.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1,3-benzoxazol-2-ylsulfanyl)-N-(5-chloro-2-pyridinyl)butanamide
Also Known As: ChemDiv1_005584, BAS 02104736, 2-(1,3-benzoxazol-2-ylsulfanyl)-N-(5-chloropyridin-2-yl)butanamide, AB00104194-01, 2-benzoxazol-2-ylthio-N-(5-chloro(2-pyridyl))butanamide
| Molecular Formula | C16H14ClN3O2S |
|---|---|
| Molecular Weight | 347.05 g/mol |
| LogP | 4.3856 |
| Topological Polar Surface Area | 68.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 347.04953 |
| Heavy Atoms | 23 |
| Complexity | 786.56323 |
Chemical Identifiers
| CAS Number | 389083-70-9 |
|---|---|
| SMILES | CCC(C(=O)NC1=NC=C(C=C1)Cl)SC2=NC3=CC=CC=C3O2 |
Product Overview
2-(1,3-benzoxazol-2-ylsulfanyl)-N-(5-chloropyridin-2-yl)butanamide (CAS 389083-70-9), with molecular formula C16H14ClN3O2S and molecular weight 347.05 g/mol. IUPAC: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-(5-chloro-2-pyridinyl)butanamide.
Chemical Property Profile of 2-(1,3-benzoxazol-2-ylsulfanyl)-N-(5-chloropyridin-2-yl)butanamide
Property Insights of 2-(1,3-benzoxazol-2-ylsulfanyl)-N-(5-chloropyridin-2-yl)butanamide
The XLogP value of 4.3856 indicates that 2-(1,3-benzoxazol-2-ylsulfanyl)-N-(5-chloropyridin-2-yl)butanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.02 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(1,3-benzoxazol-2-ylsulfanyl)-N-(5-chloropyridin-2-yl)butanamide. Following Lipinski's Rule of Five, 2-(1,3-benzoxazol-2-ylsulfanyl)-N-(5-chloropyridin-2-yl)butanamide 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 2-(1,3-benzoxazol-2-ylsulfanyl)-N-(5-chloropyridin-2-yl)butanamide?
The CAS number of 2-(1,3-benzoxazol-2-ylsulfanyl)-N-(5-chloropyridin-2-yl)butanamide is 389083-70-9.
What is the molecular formula of 2-(1,3-benzoxazol-2-ylsulfanyl)-N-(5-chloropyridin-2-yl)butanamide?
The molecular formula of 2-(1,3-benzoxazol-2-ylsulfanyl)-N-(5-chloropyridin-2-yl)butanamide is C16H14ClN3O2S.
What is the molecular weight of 2-(1,3-benzoxazol-2-ylsulfanyl)-N-(5-chloropyridin-2-yl)butanamide?
The molecular weight of 2-(1,3-benzoxazol-2-ylsulfanyl)-N-(5-chloropyridin-2-yl)butanamide is 347.05 g/mol.
Where can I buy 2-(1,3-benzoxazol-2-ylsulfanyl)-N-(5-chloropyridin-2-yl)butanamide?
You can request a quote for 2-(1,3-benzoxazol-2-ylsulfanyl)-N-(5-chloropyridin-2-yl)butanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(1,3-benzoxazol-2-ylsulfanyl)-N-(5-chloropyridin-2-yl)butanamide?
Yes, KEHONG BIO provides custom synthesis services for 2-(1,3-benzoxazol-2-ylsulfanyl)-N-(5-chloropyridin-2-yl)butanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.