AB01312593-01
TL;DR: AB01312593-01 (CAS 407587-57-9) is a chemical compound with molecular formula C24H29ClN2O3S and molecular weight 460.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[6-tert-butyl-3-(morpholine-4-carbonyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-chlorobenzamide
Also Known As: AB01312593-01, AP-064/15228389, N-[6-tert-butyl-3-(morpholine-4-carbonyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-chlorobenzamide, N-[6-tert-butyl-3-(4-morpholinylcarbonyl)-4,5,6,7-tetrahydro-1-benzothien-2-yl]-2-chlorobenzamide
| Molecular Formula | C24H29ClN2O3S |
|---|---|
| Molecular Weight | 460.16 g/mol |
| LogP | 5.2772 |
| Topological Polar Surface Area | 58.64 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 460.15875 |
| Heavy Atoms | 31 |
| Complexity | 989.196 |
Chemical Identifiers
| CAS Number | 407587-57-9 |
|---|---|
| SMILES | CC(C)(C)C1CCC2=C(C1)SC(=C2C(=O)N3CCOCC3)NC(=O)C4=CC=CC=C4Cl |
Product Overview
AB01312593-01 (CAS 407587-57-9), with molecular formula C24H29ClN2O3S and molecular weight 460.16 g/mol. IUPAC: N-[6-tert-butyl-3-(morpholine-4-carbonyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-chlorobenzamide.
Chemical Property Profile of AB01312593-01
Property Insights of AB01312593-01
The XLogP value of 5.2772 indicates that AB01312593-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.64 Ų, AB01312593-01 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AB01312593-01 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 AB01312593-01?
The CAS number of AB01312593-01 is 407587-57-9.
What is the molecular formula of AB01312593-01?
The molecular formula of AB01312593-01 is C24H29ClN2O3S.
What is the molecular weight of AB01312593-01?
The molecular weight of AB01312593-01 is 460.16 g/mol.
Where can I buy AB01312593-01?
You can request a quote for AB01312593-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB01312593-01?
Yes, KEHONG BIO provides custom synthesis services for AB01312593-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.