3H-433S
TL;DR: 3H-433S (CAS 338409-56-6) is a chemical compound with molecular formula C19H15Cl2NO3S and molecular weight 407.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[4-[(3,4-dichlorophenyl)methoxy]-5-methyl-1,3-thiazol-2-yl]benzoate
Also Known As: 3H-433S, methyl 4-{4-[(3,4-dichlorobenzyl)oxy]-5-methyl-1,3-thiazol-2-yl}benzenecarboxylate, methyl 4-[4-[(3,4-dichlorophenyl)methoxy]-5-methyl-1,3-thiazol-2-yl]benzoate, methyl 4-{4-[(3,4-dichlorophenyl)methoxy]-5-methyl-1,3-thiazol-2-yl}benzoate, methyl4-{4-[(3,4-dichlorophenyl)methoxy]-5-methyl-1,3-thiazol-2-yl}benzoate
| Molecular Formula | C19H15Cl2NO3S |
|---|---|
| Molecular Weight | 407.01 g/mol |
| LogP | 5.79092 |
| Topological Polar Surface Area | 48.42 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 407.01498 |
| Heavy Atoms | 26 |
| Complexity | 938.45734 |
Chemical Identifiers
| CAS Number | 338409-56-6 |
|---|---|
| SMILES | CC1=C(N=C(S1)C2=CC=C(C=C2)C(=O)OC)OCC3=CC(=C(C=C3)Cl)Cl |
Product Overview
3H-433S (CAS 338409-56-6), with molecular formula C19H15Cl2NO3S and molecular weight 407.01 g/mol. IUPAC: methyl 4-[4-[(3,4-dichlorophenyl)methoxy]-5-methyl-1,3-thiazol-2-yl]benzoate.
Chemical Property Profile of 3H-433S
Property Insights of 3H-433S
The XLogP value of 5.79092 indicates that 3H-433S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 48.42 Ų, 3H-433S exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3H-433S has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3H-433S?
The CAS number of 3H-433S is 338409-56-6.
What is the molecular formula of 3H-433S?
The molecular formula of 3H-433S is C19H15Cl2NO3S.
What is the molecular weight of 3H-433S?
The molecular weight of 3H-433S is 407.01 g/mol.
Where can I buy 3H-433S?
You can request a quote for 3H-433S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3H-433S?
Yes, KEHONG BIO provides custom synthesis services for 3H-433S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.