AB00673955-01
TL;DR: AB00673955-01 (CAS 864938-68-1) is a chemical compound with molecular formula C20H21N3O4S and molecular weight 399.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-benzyl-2-(2,3-dihydro-1,4-dioxine-5-carbonylamino)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxamide
Also Known As: AB00673955-01, F1301-0248, 6-benzyl-2-(5,6-dihydro-1,4-dioxine-2-carboxamido)-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxamide, 6-benzyl-2-(2,3-dihydro-1,4-dioxine-5-carbonylamino)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxamide, 6-benzyl-2-(5,6-dihydro-1,4-dioxine-2-amido)-4H,5H,6H,7H-thieno[2,3-c]pyridine-3-carboxamide
| Molecular Formula | C20H21N3O4S |
|---|---|
| Molecular Weight | 399.13 g/mol |
| LogP | 2.232 |
| Topological Polar Surface Area | 93.89 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 399.12527 |
| Heavy Atoms | 28 |
| Complexity | 923.03204 |
Chemical Identifiers
| CAS Number | 864938-68-1 |
|---|---|
| SMILES | C1CN(CC2=C1C(=C(S2)NC(=O)C3=COCCO3)C(=O)N)CC4=CC=CC=C4 |
Product Overview
AB00673955-01 (CAS 864938-68-1), with molecular formula C20H21N3O4S and molecular weight 399.13 g/mol. IUPAC: 6-benzyl-2-(2,3-dihydro-1,4-dioxine-5-carbonylamino)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxamide.
Chemical Property Profile of AB00673955-01
Property Insights of AB00673955-01
The XLogP value of 2.232 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00673955-01. The TPSA of 93.89 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00673955-01. Following Lipinski's Rule of Five, AB00673955-01 has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AB00673955-01?
The CAS number of AB00673955-01 is 864938-68-1.
What is the molecular formula of AB00673955-01?
The molecular formula of AB00673955-01 is C20H21N3O4S.
What is the molecular weight of AB00673955-01?
The molecular weight of AB00673955-01 is 399.13 g/mol.
Where can I buy AB00673955-01?
You can request a quote for AB00673955-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00673955-01?
Yes, KEHONG BIO provides custom synthesis services for AB00673955-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.