ChemDiv1_005985
TL;DR: ChemDiv1_005985 (CAS 389138-65-2) is a chemical compound with molecular formula C26H25N3O3S and molecular weight 459.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-methoxyphenyl)-4-oxo-3-(2-phenylethyl)-2-phenylimino-1,3-thiazinane-6-carboxamide
Also Known As: ChemDiv1_005985, BIM-0042132.P001, (Z)-N-(4-methoxyphenyl)-4-oxo-3-phenethyl-2-(phenylimino)-1,3-thiazinane-6-carboxamide, (2E)-N-(4-methoxyphenyl)-4-oxo-3-(2-phenylethyl)-2-(phenylimino)-1,3-thiazinane-6-carboxamide, (2Z)-N-(4-methoxyphenyl)-4-oxo-3-(2-phenylethyl)-2-(phenylimino)-1,3-thiazinane-6-carboxamide
| Molecular Formula | C26H25N3O3S |
|---|---|
| Molecular Weight | 459.16 g/mol |
| LogP | 4.8982 |
| Topological Polar Surface Area | 71.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 459.16165 |
| Heavy Atoms | 33 |
| Complexity | 1118.5387 |
Chemical Identifiers
| CAS Number | 389138-65-2 |
|---|---|
| SMILES | COC1=CC=C(C=C1)NC(=O)C2CC(=O)N(C(=NC3=CC=CC=C3)S2)CCC4=CC=CC=C4 |
Product Overview
ChemDiv1_005985 (CAS 389138-65-2), with molecular formula C26H25N3O3S and molecular weight 459.16 g/mol. IUPAC: N-(4-methoxyphenyl)-4-oxo-3-(2-phenylethyl)-2-phenylimino-1,3-thiazinane-6-carboxamide.
Chemical Property Profile of ChemDiv1_005985
Property Insights of ChemDiv1_005985
The XLogP value of 4.8982 indicates that ChemDiv1_005985 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.0 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_005985. Following Lipinski's Rule of Five, ChemDiv1_005985 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 ChemDiv1_005985?
The CAS number of ChemDiv1_005985 is 389138-65-2.
What is the molecular formula of ChemDiv1_005985?
The molecular formula of ChemDiv1_005985 is C26H25N3O3S.
What is the molecular weight of ChemDiv1_005985?
The molecular weight of ChemDiv1_005985 is 459.16 g/mol.
Where can I buy ChemDiv1_005985?
You can request a quote for ChemDiv1_005985 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_005985?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_005985 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.