AN-465/41068478
TL;DR: AN-465/41068478 (CAS 431978-89-1) is a chemical compound with molecular formula C22H19N3O2S2 and molecular weight 421.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[4-(5-propan-2-yl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl]thiophene-2-carboxamide
Also Known As: AN-465/41068478, N-({4-[5-(propan-2-yl)-1,3-benzoxazol-2-yl]phenyl}carbamothioyl)thiophene-2-carboxamide, N-[[4-(5-propan-2-yl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl]thiophene-2-carboxamide, N-[4-(5-isopropyl-1,3-benzoxazol-2-yl)phenyl]-N'-(2-thienylcarbonyl)thiourea
| Molecular Formula | C22H19N3O2S2 |
|---|---|
| Molecular Weight | 421.09 g/mol |
| LogP | 5.8065 |
| Topological Polar Surface Area | 67.16 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 421.09186 |
| Heavy Atoms | 29 |
| Complexity | 1162.7257 |
Chemical Identifiers
| CAS Number | 431978-89-1 |
|---|---|
| SMILES | CC(C)C1=CC2=C(C=C1)OC(=N2)C3=CC=C(C=C3)NC(=S)NC(=O)C4=CC=CS4 |
Product Overview
AN-465/41068478 (CAS 431978-89-1), with molecular formula C22H19N3O2S2 and molecular weight 421.09 g/mol. IUPAC: N-[[4-(5-propan-2-yl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl]thiophene-2-carboxamide.
Chemical Property Profile of AN-465/41068478
Property Insights of AN-465/41068478
The XLogP value of 5.8065 indicates that AN-465/41068478 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.16 Ų falls within the moderate polarity range, balancing permeability and solubility for AN-465/41068478. Following Lipinski's Rule of Five, AN-465/41068478 has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AN-465/41068478?
The CAS number of AN-465/41068478 is 431978-89-1.
What is the molecular formula of AN-465/41068478?
The molecular formula of AN-465/41068478 is C22H19N3O2S2.
What is the molecular weight of AN-465/41068478?
The molecular weight of AN-465/41068478 is 421.09 g/mol.
Where can I buy AN-465/41068478?
You can request a quote for AN-465/41068478 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-465/41068478?
Yes, KEHONG BIO provides custom synthesis services for AN-465/41068478 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.