AN-329/12683005
TL;DR: AN-329/12683005 (CAS 307340-45-0) is a chemical compound with molecular formula C27H21ClN4OS and molecular weight 484.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4Z)-2-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-4-[[4-(dimethylamino)phenyl]methylidene]-5-phenylpyrazol-3-one
Also Known As: AN-329/12683005, (4Z)-2-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-4-[4-(dimethylamino)benzylidene]-5-phenyl-2,4-dihydro-3H-pyrazol-3-one, (4Z)-2-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-4-[(4-dimethylaminophenyl)methylidene]-5-phenyl-pyrazol-3-one, 2-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-4-[4-(dimethylamino)benzylidene]-5-phenyl-2,4-dihydro-3H-pyrazol-3-one, (4Z)-1-[4-(4-CHLOROPHENYL)-1,3-THIAZOL-2-YL]-4-{[4-(DIMETHYLAMINO)PHENYL]METHYLIDENE}-3-PHENYL-4,5-DIHYDRO-1H-PYRAZOL-5-ONE
| Molecular Formula | C27H21ClN4OS |
|---|---|
| Molecular Weight | 484.11 g/mol |
| LogP | 6.364 |
| Topological Polar Surface Area | 48.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 484.11246 |
| Heavy Atoms | 34 |
| Complexity | 1390.8429 |
Chemical Identifiers
| CAS Number | 307340-45-0 |
|---|---|
| SMILES | CN(C)C1=CC=C(C=C1)/C=C\2/C(=NN(C2=O)C3=NC(=CS3)C4=CC=C(C=C4)Cl)C5=CC=CC=C5 |
Product Overview
AN-329/12683005 (CAS 307340-45-0), with molecular formula C27H21ClN4OS and molecular weight 484.11 g/mol. IUPAC: (4Z)-2-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-4-[[4-(dimethylamino)phenyl]methylidene]-5-phenylpyrazol-3-one.
Chemical Property Profile of AN-329/12683005
Property Insights of AN-329/12683005
The XLogP value of 6.364 indicates that AN-329/12683005 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 48.8 Ų, AN-329/12683005 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AN-329/12683005 has 0 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-329/12683005?
The CAS number of AN-329/12683005 is 307340-45-0.
What is the molecular formula of AN-329/12683005?
The molecular formula of AN-329/12683005 is C27H21ClN4OS.
What is the molecular weight of AN-329/12683005?
The molecular weight of AN-329/12683005 is 484.11 g/mol.
Where can I buy AN-329/12683005?
You can request a quote for AN-329/12683005 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-329/12683005?
Yes, KEHONG BIO provides custom synthesis services for AN-329/12683005 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.