A1837/0077366
TL;DR: A1837/0077366 (CAS 6096-20-4) is a chemical compound with molecular formula C18H15BrN2O3S and molecular weight 418.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-2-amino-5-[(3-bromo-5-methoxy-4-phenylmethoxyphenyl)methylidene]-1,3-thiazol-4-one
Also Known As: A1837/0077366, (5Z)-2-amino-5-[(3-bromo-5-methoxy-4-phenylmethoxyphenyl)methylidene]-1,3-thiazol-4-one, 5-[4-(benzyloxy)-3-bromo-5-methoxybenzylidene]-2-imino-1,3-thiazolidin-4-one, (5Z)-5-{[4-(BENZYLOXY)-3-BROMO-5-METHOXYPHENYL]METHYLIDENE}-2-IMINO-1,3-THIAZOLIDIN-4-ONE
| Molecular Formula | C18H15BrN2O3S |
|---|---|
| Molecular Weight | 418.00 g/mol |
| LogP | 3.9657 |
| Topological Polar Surface Area | 73.91 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 417.9987 |
| Heavy Atoms | 25 |
| Complexity | 866.12494 |
Chemical Identifiers
| CAS Number | 6096-20-4 |
|---|---|
| SMILES | COC1=C(C(=CC(=C1)/C=C\2/C(=O)N=C(S2)N)Br)OCC3=CC=CC=C3 |
Product Overview
A1837/0077366 (CAS 6096-20-4), with molecular formula C18H15BrN2O3S and molecular weight 418.00 g/mol. IUPAC: (5Z)-2-amino-5-[(3-bromo-5-methoxy-4-phenylmethoxyphenyl)methylidene]-1,3-thiazol-4-one.
Chemical Property Profile of A1837/0077366
Property Insights of A1837/0077366
The XLogP value of 3.9657 indicates that A1837/0077366 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.91 Ų falls within the moderate polarity range, balancing permeability and solubility for A1837/0077366. Following Lipinski's Rule of Five, A1837/0077366 has 1 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 A1837/0077366?
The CAS number of A1837/0077366 is 6096-20-4.
What is the molecular formula of A1837/0077366?
The molecular formula of A1837/0077366 is C18H15BrN2O3S.
What is the molecular weight of A1837/0077366?
The molecular weight of A1837/0077366 is 418.00 g/mol.
Where can I buy A1837/0077366?
You can request a quote for A1837/0077366 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A1837/0077366?
Yes, KEHONG BIO provides custom synthesis services for A1837/0077366 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.