TimTec1_002394
TL;DR: TimTec1_002394 (CAS 442630-96-8) is a chemical compound with molecular formula C16H24N4O4 and molecular weight 336.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(4-hydroxy-4-methyl-2-oxo-1-oxa-3-azaspiro[4.5]decan-3-yl)ethyl]-2-methylpyrazole-3-carboxamide
Also Known As: TimTec1_002394, BRD-A10345677-001-01-4, A2686/0114526, N-[2-(4-Hydroxy-4-methyl-2-oxo-1-oxa-3-azaspiro[4.5]dec-3-yl)ethyl]-1-methyl-1H-pyrazole-5-carboxamide, 2-Methyl-2H-pyrazole-3-carboxylic acid [2-(4-hydroxy-4-methyl-2-oxo-1-oxa-3-aza-spiro[4.5]dec-3-yl)-ethyl]-amide
| Molecular Formula | C16H24N4O4 |
|---|---|
| Molecular Weight | 336.18 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 96.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 336.17975 |
| Heavy Atoms | 24 |
| Complexity | 508.0 |
Chemical Identifiers
| CAS Number | 442630-96-8 |
|---|---|
| SMILES | CC1(C2(CCCCC2)OC(=O)N1CCNC(=O)C3=CC=NN3C)O |
| InChIKey | PEYXMXXCBSGVDN-UHFFFAOYSA-N |
Product Overview
TimTec1_002394 (CAS 442630-96-8), with molecular formula C16H24N4O4 and molecular weight 336.18 g/mol. IUPAC: N-[2-(4-hydroxy-4-methyl-2-oxo-1-oxa-3-azaspiro[4.5]decan-3-yl)ethyl]-2-methylpyrazole-3-carboxamide.
Chemical Property Profile of TimTec1_002394
Property Insights of TimTec1_002394
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for TimTec1_002394. The TPSA of 96.7 Ų falls within the moderate polarity range, balancing permeability and solubility for TimTec1_002394. Following Lipinski's Rule of Five, TimTec1_002394 has 2 hydrogen bond donor(s) and 5 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_002394?
The CAS number of TimTec1_002394 is 442630-96-8.
What is the molecular formula of TimTec1_002394?
The molecular formula of TimTec1_002394 is C16H24N4O4.
What is the molecular weight of TimTec1_002394?
The molecular weight of TimTec1_002394 is 336.18 g/mol.
Where can I buy TimTec1_002394?
You can request a quote for TimTec1_002394 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for TimTec1_002394?
Yes, KEHONG BIO provides custom synthesis services for TimTec1_002394 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.