TimTec1_000350
TL;DR: TimTec1_000350 (CAS 321945-58-8) is a chemical compound with molecular formula C21H17NO4 and molecular weight 347.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(16,18-dioxo-17-azapentacyclo[6.6.5.02,7.09,14.015,19]nonadeca-2,4,6,9,11,13-hexaen-17-yl)propanoic acid
Also Known As: TimTec1_000350, BAS 00389581, AB00685268-01, BRD-A42399801-001-01-2, F0827-0042
| Molecular Formula | C21H17NO4 |
|---|---|
| Molecular Weight | 347.12 g/mol |
| LogP | 2.3533 |
| Topological Polar Surface Area | 74.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 347.11575 |
| Heavy Atoms | 26 |
| Complexity | 850.48834 |
Chemical Identifiers
| CAS Number | 321945-58-8 |
|---|---|
| SMILES | C1=CC=C2C3C4C(C(C2=C1)C5=CC=CC=C35)C(=O)N(C4=O)CCC(=O)O |
Product Overview
TimTec1_000350 (CAS 321945-58-8), with molecular formula C21H17NO4 and molecular weight 347.12 g/mol. IUPAC: 3-(16,18-dioxo-17-azapentacyclo[6.6.5.02,7.09,14.015,19]nonadeca-2,4,6,9,11,13-hexaen-17-yl)propanoic acid.
Chemical Property Profile of TimTec1_000350
Property Insights of TimTec1_000350
The XLogP value of 2.3533 suggests moderate lipophilicity, balancing water solubility and membrane permeability for TimTec1_000350. The TPSA of 74.68 Ų falls within the moderate polarity range, balancing permeability and solubility for TimTec1_000350. Following Lipinski's Rule of Five, TimTec1_000350 has 1 hydrogen bond donor(s) and 3 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_000350?
The CAS number of TimTec1_000350 is 321945-58-8.
What is the molecular formula of TimTec1_000350?
The molecular formula of TimTec1_000350 is C21H17NO4.
What is the molecular weight of TimTec1_000350?
The molecular weight of TimTec1_000350 is 347.12 g/mol.
Where can I buy TimTec1_000350?
You can request a quote for TimTec1_000350 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for TimTec1_000350?
Yes, KEHONG BIO provides custom synthesis services for TimTec1_000350 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.