IDI1_010698
TL;DR: IDI1_010698 (CAS 871015-41-7) is a chemical compound with molecular formula C19H17N3O2S and molecular weight 351.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-N-(6-acetyl-3-cyano-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl)-3-phenylprop-2-enamide
Also Known As: IDI1_010698, F1298-0852, (2E)-N-{6-acetyl-3-cyano-4H,5H,6H,7H-thieno[2,3-c]pyridin-2-yl}-3-phenylprop-2-enamide, (E)-N-(6-acetyl-3-cyano-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl)-3-phenylprop-2-enamide, N-(6-acetyl-3-cyano-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-yl)cinnamamide
| Molecular Formula | C19H17N3O2S |
|---|---|
| Molecular Weight | 351.10 g/mol |
| LogP | 3.17628 |
| Topological Polar Surface Area | 73.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 351.10416 |
| Heavy Atoms | 25 |
| Complexity | 878.06445 |
Chemical Identifiers
| CAS Number | 871015-41-7 |
|---|---|
| SMILES | CC(=O)N1CCC2=C(C1)SC(=C2C#N)NC(=O)/C=C/C3=CC=CC=C3 |
Product Overview
IDI1_010698 (CAS 871015-41-7), with molecular formula C19H17N3O2S and molecular weight 351.10 g/mol. IUPAC: (E)-N-(6-acetyl-3-cyano-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl)-3-phenylprop-2-enamide.
Chemical Property Profile of IDI1_010698
Property Insights of IDI1_010698
The XLogP value of 3.17628 indicates that IDI1_010698 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.2 Ų falls within the moderate polarity range, balancing permeability and solubility for IDI1_010698. Following Lipinski's Rule of Five, IDI1_010698 has 1 hydrogen bond donor(s) and 4 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 IDI1_010698?
The CAS number of IDI1_010698 is 871015-41-7.
What is the molecular formula of IDI1_010698?
The molecular formula of IDI1_010698 is C19H17N3O2S.
What is the molecular weight of IDI1_010698?
The molecular weight of IDI1_010698 is 351.10 g/mol.
Where can I buy IDI1_010698?
You can request a quote for IDI1_010698 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for IDI1_010698?
Yes, KEHONG BIO provides custom synthesis services for IDI1_010698 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.