AB00743774-01
TL;DR: AB00743774-01 (CAS 631859-05-7) is a chemical compound with molecular formula C25H28FN3OS and molecular weight 437.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3-[(4-fluorophenyl)-(4-methylpiperazin-1-yl)methyl]-4,5-dimethylthiophen-2-yl]benzamide
Also Known As: AB00743774-01, N-{3-[(4-fluorophenyl)(4-methylpiperazin-1-yl)methyl]-4,5-dimethylthiophen-2-yl}benzamide, N-[3-[(4-fluorophenyl)-(4-methylpiperazin-1-yl)methyl]-4,5-dimethylthiophen-2-yl]benzamide, N-{3-[(4-fluorophenyl)(4-methylpiperazinyl)methyl]-4,5-dimethyl(2-thienyl)}ben zamide, N-[3-[(4-fluorophenyl)-(4-methylpiperazin-1-yl)methyl]-4,5-dimethyl-thiophen-2-yl]benzamide
| Molecular Formula | C25H28FN3OS |
|---|---|
| Molecular Weight | 437.19 g/mol |
| LogP | 5.09314 |
| Topological Polar Surface Area | 35.58 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 437.19373 |
| Heavy Atoms | 31 |
| Complexity | 1040.634 |
Chemical Identifiers
| CAS Number | 631859-05-7 |
|---|---|
| SMILES | CC1=C(SC(=C1C(C2=CC=C(C=C2)F)N3CCN(CC3)C)NC(=O)C4=CC=CC=C4)C |
Product Overview
AB00743774-01 (CAS 631859-05-7), with molecular formula C25H28FN3OS and molecular weight 437.19 g/mol. IUPAC: N-[3-[(4-fluorophenyl)-(4-methylpiperazin-1-yl)methyl]-4,5-dimethylthiophen-2-yl]benzamide.
Chemical Property Profile of AB00743774-01
Property Insights of AB00743774-01
The XLogP value of 5.09314 indicates that AB00743774-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.58 Ų, AB00743774-01 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AB00743774-01 has 1 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 AB00743774-01?
The CAS number of AB00743774-01 is 631859-05-7.
What is the molecular formula of AB00743774-01?
The molecular formula of AB00743774-01 is C25H28FN3OS.
What is the molecular weight of AB00743774-01?
The molecular weight of AB00743774-01 is 437.19 g/mol.
Where can I buy AB00743774-01?
You can request a quote for AB00743774-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00743774-01?
Yes, KEHONG BIO provides custom synthesis services for AB00743774-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.