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N-[3-(tert-butyl)-4-(4-chlorophenyl)-1,3-thiazol-2(3H)-yliden](3-pyridinyl)methanamine
TL;DR: N-[3-(tert-butyl)-4-(4-chlorophenyl)-1,3-thiazol-2(3H)-yliden](3-pyridinyl)methanamine (CAS 866009-98-5) is a chemical compound with molecular formula C19H20ClN3S and molecular weight 357.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-tert-butyl-4-(4-chlorophenyl)-N-(pyridin-3-ylmethyl)-1,3-thiazol-2-imine
Also Known As: N-[3-(tert-butyl)-4-(4-chlorophenyl)-1,3-thiazol-2(3H)-yliden](3-pyridinyl)methanamine, 3-tert-butyl-4-(4-chlorophenyl)-N-(pyridin-3-ylmethyl)-1,3-thiazol-2-imine, N-[(2Z)-3-tert-butyl-4-(4-chlorophenyl)-2,3-dihydro-1,3-thiazol-2-ylidene]-1-(pyridin-3-yl)methanamine, 4-(4-chlorophenyl)-N-(pyridin-3-ylmethyl)-3-tert-butyl-1,3-thiazol-2-imine
| Molecular Formula | C19H20ClN3S |
|---|---|
| Molecular Weight | 357.11 g/mol |
| LogP | 5.1209 |
| Topological Polar Surface Area | 30.18 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 357.10666 |
| Heavy Atoms | 24 |
| Complexity | 871.4705 |
Chemical Identifiers
| CAS Number | 866009-98-5 |
|---|---|
| SMILES | CC(C)(C)N1C(=CSC1=NCC2=CN=CC=C2)C3=CC=C(C=C3)Cl |
Product Overview
N-[3-(tert-butyl)-4-(4-chlorophenyl)-1,3-thiazol-2(3H)-yliden](3-pyridinyl)methanamine (CAS 866009-98-5), with molecular formula C19H20ClN3S and molecular weight 357.11 g/mol. IUPAC: 3-tert-butyl-4-(4-chlorophenyl)-N-(pyridin-3-ylmethyl)-1,3-thiazol-2-imine.
Chemical Property Profile of N-[3-(tert-butyl)-4-(4-chlorophenyl)-1,3-thiazol-2(3H)-yliden](3-pyridinyl)methanamine
Property Insights of N-[3-(tert-butyl)-4-(4-chlorophenyl)-1,3-thiazol-2(3H)-yliden](3-pyridinyl)methanamine
The XLogP value of 5.1209 indicates that N-[3-(tert-butyl)-4-(4-chlorophenyl)-1,3-thiazol-2(3H)-yliden](3-pyridinyl)methanamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 30.18 Ų, N-[3-(tert-butyl)-4-(4-chlorophenyl)-1,3-thiazol-2(3H)-yliden](3-pyridinyl)methanamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[3-(tert-butyl)-4-(4-chlorophenyl)-1,3-thiazol-2(3H)-yliden](3-pyridinyl)methanamine has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-[3-(tert-butyl)-4-(4-chlorophenyl)-1,3-thiazol-2(3H)-yliden](3-pyridinyl)methanamine?
The CAS number of N-[3-(tert-butyl)-4-(4-chlorophenyl)-1,3-thiazol-2(3H)-yliden](3-pyridinyl)methanamine is 866009-98-5.
What is the molecular formula of N-[3-(tert-butyl)-4-(4-chlorophenyl)-1,3-thiazol-2(3H)-yliden](3-pyridinyl)methanamine?
The molecular formula of N-[3-(tert-butyl)-4-(4-chlorophenyl)-1,3-thiazol-2(3H)-yliden](3-pyridinyl)methanamine is C19H20ClN3S.
What is the molecular weight of N-[3-(tert-butyl)-4-(4-chlorophenyl)-1,3-thiazol-2(3H)-yliden](3-pyridinyl)methanamine?
The molecular weight of N-[3-(tert-butyl)-4-(4-chlorophenyl)-1,3-thiazol-2(3H)-yliden](3-pyridinyl)methanamine is 357.11 g/mol.
Where can I buy N-[3-(tert-butyl)-4-(4-chlorophenyl)-1,3-thiazol-2(3H)-yliden](3-pyridinyl)methanamine?
You can request a quote for N-[3-(tert-butyl)-4-(4-chlorophenyl)-1,3-thiazol-2(3H)-yliden](3-pyridinyl)methanamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[3-(tert-butyl)-4-(4-chlorophenyl)-1,3-thiazol-2(3H)-yliden](3-pyridinyl)methanamine?
Yes, KEHONG BIO provides custom synthesis services for N-[3-(tert-butyl)-4-(4-chlorophenyl)-1,3-thiazol-2(3H)-yliden](3-pyridinyl)methanamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.