A3240/0137601
TL;DR: A3240/0137601 (CAS 470720-29-7) is a chemical compound with molecular formula C27H25N3O4S and molecular weight 487.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[[3-benzyl-4-oxo-6-(phenylcarbamoyl)-1,3-thiazinan-2-ylidene]amino]benzoate
Also Known As: A3240/0137601, (Z)-ethyl 4-((3-benzyl-4-oxo-6-(phenylcarbamoyl)-1,3-thiazinan-2-ylidene)amino)benzoate, ethyl 4-[[3-benzyl-4-oxo-6-(phenylcarbamoyl)-1,3-thiazinan-2-ylidene]amino]benzoate, ethyl 4-{[(2E)-3-benzyl-4-oxo-6-(phenylcarbamoyl)-1,3-thiazinan-2-ylidene]amino}benzoate, ETHYL 4-{[6-(ANILINOCARBONYL)-3-BENZYL-4-OXO-1,3-THIAZINAN-2-YLIDEN]AMINO}BENZOATE
| Molecular Formula | C27H25N3O4S |
|---|---|
| Molecular Weight | 487.16 g/mol |
| LogP | 5.0238 |
| Topological Polar Surface Area | 88.07 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 487.1566 |
| Heavy Atoms | 35 |
| Complexity | 1214.1934 |
Chemical Identifiers
| CAS Number | 470720-29-7 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)N=C2N(C(=O)CC(S2)C(=O)NC3=CC=CC=C3)CC4=CC=CC=C4 |
Product Overview
A3240/0137601 (CAS 470720-29-7), with molecular formula C27H25N3O4S and molecular weight 487.16 g/mol. IUPAC: ethyl 4-[[3-benzyl-4-oxo-6-(phenylcarbamoyl)-1,3-thiazinan-2-ylidene]amino]benzoate.
Chemical Property Profile of A3240/0137601
Property Insights of A3240/0137601
The XLogP value of 5.0238 indicates that A3240/0137601 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.07 Ų falls within the moderate polarity range, balancing permeability and solubility for A3240/0137601. Following Lipinski's Rule of Five, A3240/0137601 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of A3240/0137601?
The CAS number of A3240/0137601 is 470720-29-7.
What is the molecular formula of A3240/0137601?
The molecular formula of A3240/0137601 is C27H25N3O4S.
What is the molecular weight of A3240/0137601?
The molecular weight of A3240/0137601 is 487.16 g/mol.
Where can I buy A3240/0137601?
You can request a quote for A3240/0137601 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3240/0137601?
Yes, KEHONG BIO provides custom synthesis services for A3240/0137601 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.