TimTec1_005467
TL;DR: TimTec1_005467 (CAS 302936-96-5) is a chemical compound with molecular formula C23H19ClN4O and molecular weight 402.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(benzylamino)-3-[(4-chlorophenyl)iminomethyl]-7-methylpyrido[1,2-a]pyrimidin-4-one
Also Known As: TimTec1_005467, AB00674385-01, F1430-0071, 2-(benzylamino)-3-[(1E)-[(4-chlorophenyl)imino]methyl]-7-methyl-4H-pyrido[1,2-a]pyrimidin-4-one, (E)-2-(benzylamino)-3-(((4-chlorophenyl)imino)methyl)-7-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
| Molecular Formula | C23H19ClN4O |
|---|---|
| Molecular Weight | 402.12 g/mol |
| LogP | 5.01902 |
| Topological Polar Surface Area | 58.76 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 402.12473 |
| Heavy Atoms | 29 |
| Complexity | 1231.6953 |
Chemical Identifiers
| CAS Number | 302936-96-5 |
|---|---|
| SMILES | CC1=CN2C(=NC(=C(C2=O)C=NC3=CC=C(C=C3)Cl)NCC4=CC=CC=C4)C=C1 |
Product Overview
TimTec1_005467 (CAS 302936-96-5), with molecular formula C23H19ClN4O and molecular weight 402.12 g/mol. IUPAC: 2-(benzylamino)-3-[(4-chlorophenyl)iminomethyl]-7-methylpyrido[1,2-a]pyrimidin-4-one.
Chemical Property Profile of TimTec1_005467
Property Insights of TimTec1_005467
The XLogP value of 5.01902 indicates that TimTec1_005467 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.76 Ų, TimTec1_005467 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, TimTec1_005467 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of TimTec1_005467?
The CAS number of TimTec1_005467 is 302936-96-5.
What is the molecular formula of TimTec1_005467?
The molecular formula of TimTec1_005467 is C23H19ClN4O.
What is the molecular weight of TimTec1_005467?
The molecular weight of TimTec1_005467 is 402.12 g/mol.
Where can I buy TimTec1_005467?
You can request a quote for TimTec1_005467 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for TimTec1_005467?
Yes, KEHONG BIO provides custom synthesis services for TimTec1_005467 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.