A3507/0148544
TL;DR: A3507/0148544 (CAS 519146-42-0) is a chemical compound with molecular formula C28H26ClN3O4S and molecular weight 535.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[[6-[(2-chlorophenyl)carbamoyl]-4-oxo-3-(2-phenylethyl)-1,3-thiazinan-2-ylidene]amino]benzoate
Also Known As: A3507/0148544, ethyl 4-{[(2Z)-6-[(2-chlorophenyl)carbamoyl]-4-oxo-3-(2-phenylethyl)-1,3-thiazinan-2-ylidene]amino}benzoate, (Z)-ethyl 4-((6-((2-chlorophenyl)carbamoyl)-4-oxo-3-phenethyl-1,3-thiazinan-2-ylidene)amino)benzoate, ETHYL 4-({6-[(2-CHLOROANILINO)CARBONYL]-4-OXO-3-PHENETHYL-1,3-THIAZINAN-2-YLIDEN}AMINO)BENZOATE, ethyl 4-[[6-[(2-chlorophenyl)carbamoyl]-4-oxo-3-phenethyl-1,3-thiazinan-2-ylidene]amino]benzoate
| Molecular Formula | C28H26ClN3O4S |
|---|---|
| Molecular Weight | 535.13 g/mol |
| LogP | 5.7197 |
| Topological Polar Surface Area | 88.07 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 535.13324 |
| Heavy Atoms | 37 |
| Complexity | 1298.2941 |
Chemical Identifiers
| CAS Number | 519146-42-0 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)N=C2N(C(=O)CC(S2)C(=O)NC3=CC=CC=C3Cl)CCC4=CC=CC=C4 |
Product Overview
A3507/0148544 (CAS 519146-42-0), with molecular formula C28H26ClN3O4S and molecular weight 535.13 g/mol. IUPAC: ethyl 4-[[6-[(2-chlorophenyl)carbamoyl]-4-oxo-3-(2-phenylethyl)-1,3-thiazinan-2-ylidene]amino]benzoate.
Chemical Property Profile of A3507/0148544
Property Insights of A3507/0148544
The XLogP value of 5.7197 indicates that A3507/0148544 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 A3507/0148544. Following Lipinski's Rule of Five, A3507/0148544 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 A3507/0148544?
The CAS number of A3507/0148544 is 519146-42-0.
What is the molecular formula of A3507/0148544?
The molecular formula of A3507/0148544 is C28H26ClN3O4S.
What is the molecular weight of A3507/0148544?
The molecular weight of A3507/0148544 is 535.13 g/mol.
Where can I buy A3507/0148544?
You can request a quote for A3507/0148544 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3507/0148544?
Yes, KEHONG BIO provides custom synthesis services for A3507/0148544 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.