AN-329/42682411
TL;DR: AN-329/42682411 (CAS 717862-78-7) is a chemical compound with molecular formula C21H21N3OS2 and molecular weight 395.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]carbamothioyl]cyclopentanecarboxamide
Also Known As: AN-329/42682411, N-[[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]carbamothioyl]cyclopentanecarboxamide, N-({[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]amino}carbonothioyl)cyclopentanecarboxamide, N-{[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]carbamothioyl}cyclopentanecarboxamide, N-(cyclopentylcarbonyl)-N'-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]thiourea
| Molecular Formula | C21H21N3OS2 |
|---|---|
| Molecular Weight | 395.11 g/mol |
| LogP | 5.27492 |
| Topological Polar Surface Area | 54.02 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 395.1126 |
| Heavy Atoms | 27 |
| Complexity | 988.3343 |
Chemical Identifiers
| CAS Number | 717862-78-7 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=S)NC(=O)C4CCCC4 |
Product Overview
AN-329/42682411 (CAS 717862-78-7), with molecular formula C21H21N3OS2 and molecular weight 395.11 g/mol. IUPAC: N-[[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]carbamothioyl]cyclopentanecarboxamide.
Chemical Property Profile of AN-329/42682411
Property Insights of AN-329/42682411
The XLogP value of 5.27492 indicates that AN-329/42682411 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.02 Ų, AN-329/42682411 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AN-329/42682411 has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AN-329/42682411?
The CAS number of AN-329/42682411 is 717862-78-7.
What is the molecular formula of AN-329/42682411?
The molecular formula of AN-329/42682411 is C21H21N3OS2.
What is the molecular weight of AN-329/42682411?
The molecular weight of AN-329/42682411 is 395.11 g/mol.
Where can I buy AN-329/42682411?
You can request a quote for AN-329/42682411 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-329/42682411?
Yes, KEHONG BIO provides custom synthesis services for AN-329/42682411 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.