TimTec1_007746
TL;DR: TimTec1_007746 (CAS 489403-04-5) is a chemical compound with molecular formula C17H15N3O4 and molecular weight 325.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 6'-amino-5'-cyano-1,2'-dimethyl-2-oxospiro[indole-3,4'-pyran]-3'-carboxylate
Also Known As: TimTec1_007746, IDI1_033400, BAS 07414038, AM-807/13906002, methyl 6'-amino-5'-cyano-1,2'-dimethyl-2-oxo-1,2-dihydrospiro[indole-3,4'-pyran]-3'-carboxylate
| Molecular Formula | C17H15N3O4 |
|---|---|
| Molecular Weight | 325.11 g/mol |
| LogP | 1.07188 |
| Topological Polar Surface Area | 105.65 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 325.10626 |
| Heavy Atoms | 24 |
| Complexity | 878.067 |
Chemical Identifiers
| CAS Number | 489403-04-5 |
|---|---|
| SMILES | CC1=C(C2(C3=CC=CC=C3N(C2=O)C)C(=C(O1)N)C#N)C(=O)OC |
Product Overview
TimTec1_007746 (CAS 489403-04-5), with molecular formula C17H15N3O4 and molecular weight 325.11 g/mol. IUPAC: methyl 6'-amino-5'-cyano-1,2'-dimethyl-2-oxospiro[indole-3,4'-pyran]-3'-carboxylate.
Chemical Property Profile of TimTec1_007746
Property Insights of TimTec1_007746
The XLogP value of 1.07188 suggests moderate lipophilicity, balancing water solubility and membrane permeability for TimTec1_007746. The TPSA of 105.65 Ų falls within the moderate polarity range, balancing permeability and solubility for TimTec1_007746. Following Lipinski's Rule of Five, TimTec1_007746 has 1 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 TimTec1_007746?
The CAS number of TimTec1_007746 is 489403-04-5.
What is the molecular formula of TimTec1_007746?
The molecular formula of TimTec1_007746 is C17H15N3O4.
What is the molecular weight of TimTec1_007746?
The molecular weight of TimTec1_007746 is 325.11 g/mol.
Where can I buy TimTec1_007746?
You can request a quote for TimTec1_007746 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for TimTec1_007746?
Yes, KEHONG BIO provides custom synthesis services for TimTec1_007746 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.