3T-0218
TL;DR: 3T-0218 (CAS 861212-84-2) is a chemical compound with molecular formula C23H17ClN2O4 and molecular weight 420.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(3-chlorophenyl)methyl]-2-(3-oxo-4H-1,4-benzoxazine-6-carbonyl)benzamide
Also Known As: 3T-0218, N-(3-chlorobenzyl)-2-[(3-oxo-3,4-dihydro-2H-1,4-benzoxazin-6-yl)carbonyl]benzenecarboxamide, N-[(3-chlorophenyl)methyl]-2-(3-oxo-4H-1,4-benzoxazine-6-carbonyl)benzamide, N-[(3-chlorophenyl)methyl]-2-(3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-carbonyl)benzamide
| Molecular Formula | C23H17ClN2O4 |
|---|---|
| Molecular Weight | 420.09 g/mol |
| LogP | 3.8319 |
| Topological Polar Surface Area | 84.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 420.08768 |
| Heavy Atoms | 30 |
| Complexity | 1159.445 |
Chemical Identifiers
| CAS Number | 861212-84-2 |
|---|---|
| SMILES | C1C(=O)NC2=C(O1)C=CC(=C2)C(=O)C3=CC=CC=C3C(=O)NCC4=CC(=CC=C4)Cl |
Product Overview
3T-0218 (CAS 861212-84-2), with molecular formula C23H17ClN2O4 and molecular weight 420.09 g/mol. IUPAC: N-[(3-chlorophenyl)methyl]-2-(3-oxo-4H-1,4-benzoxazine-6-carbonyl)benzamide.
Chemical Property Profile of 3T-0218
Property Insights of 3T-0218
The XLogP value of 3.8319 indicates that 3T-0218 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 3T-0218. Following Lipinski's Rule of Five, 3T-0218 has 2 hydrogen bond donor(s) and 4 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 3T-0218?
The CAS number of 3T-0218 is 861212-84-2.
What is the molecular formula of 3T-0218?
The molecular formula of 3T-0218 is C23H17ClN2O4.
What is the molecular weight of 3T-0218?
The molecular weight of 3T-0218 is 420.09 g/mol.
Where can I buy 3T-0218?
You can request a quote for 3T-0218 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3T-0218?
Yes, KEHONG BIO provides custom synthesis services for 3T-0218 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.