C21H28N2S
TL;DR: C21H28N2S (CAS 836632-53-2) is a chemical compound with molecular formula C21H28N2S and molecular weight 340.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-N-(4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[d][1,3]thiazol-2-yl)-1-(4-methylphenyl)methanimine
Also Known As: (E)-N-(4-methylbenzylidene)-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[d]thiazol-2-amine, N-[(E)-(4-methylphenyl)methylidene]-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[d][1,3]thiazol-2-amine
| Molecular Formula | C21H28N2S |
|---|---|
| Molecular Weight | 340.20 g/mol |
| LogP | 6.42152 |
| Topological Polar Surface Area | 25.25 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 340.19733 |
| Heavy Atoms | 24 |
| Complexity | 625.47833 |
Chemical Identifiers
| CAS Number | 836632-53-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)/C=N/C2=NC3=C(S2)CCCCCCCCCC3 |
Product Overview
C21H28N2S (CAS 836632-53-2), with molecular formula C21H28N2S and molecular weight 340.20 g/mol. IUPAC: (E)-N-(4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[d][1,3]thiazol-2-yl)-1-(4-methylphenyl)methanimine.
Chemical Property Profile of C21H28N2S
Property Insights of C21H28N2S
The XLogP value of 6.42152 indicates that C21H28N2S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 25.25 Ų, C21H28N2S exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, C21H28N2S 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 C21H28N2S?
The CAS number of C21H28N2S is 836632-53-2.
What is the molecular formula of C21H28N2S?
The molecular formula of C21H28N2S is C21H28N2S.
What is the molecular weight of C21H28N2S?
The molecular weight of C21H28N2S is 340.20 g/mol.
Where can I buy C21H28N2S?
You can request a quote for C21H28N2S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C21H28N2S?
Yes, KEHONG BIO provides custom synthesis services for C21H28N2S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.