ChemDiv1_006098
TL;DR: ChemDiv1_006098 (CAS 347312-27-0) is a chemical compound with molecular formula C23H16Cl2N2O4 and molecular weight 454.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[5-(5,7-dichloro-1,3-benzoxazol-2-yl)-2-methylphenyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide
Also Known As: ChemDiv1_006098, BIM-0014238.P001, N-[5-(5,7-dichloro-1,3-benzoxazol-2-yl)-2-methylphenyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide, 2H,3H-benzo[3,4-e]1,4-dioxan-6-yl-N-[5-(5,7-dichlorobenzoxazol-2-yl)-2-methylp henyl]carboxamide, N-(5-(5,7-dichlorobenzo[d]oxazol-2-yl)-2-methylphenyl)-2,3-dihydrobenzo[b][1,4]dioxine-6-carboxamide
| Molecular Formula | C23H16Cl2N2O4 |
|---|---|
| Molecular Weight | 454.05 g/mol |
| LogP | 6.13352 |
| Topological Polar Surface Area | 73.59 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 454.0487 |
| Heavy Atoms | 31 |
| Complexity | 1332.9033 |
Chemical Identifiers
| CAS Number | 347312-27-0 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C2=NC3=C(O2)C(=CC(=C3)Cl)Cl)NC(=O)C4=CC5=C(C=C4)OCCO5 |
Product Overview
ChemDiv1_006098 (CAS 347312-27-0), with molecular formula C23H16Cl2N2O4 and molecular weight 454.05 g/mol. IUPAC: N-[5-(5,7-dichloro-1,3-benzoxazol-2-yl)-2-methylphenyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide.
Chemical Property Profile of ChemDiv1_006098
Property Insights of ChemDiv1_006098
The XLogP value of 6.13352 indicates that ChemDiv1_006098 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.59 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_006098. Following Lipinski's Rule of Five, ChemDiv1_006098 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ChemDiv1_006098?
The CAS number of ChemDiv1_006098 is 347312-27-0.
What is the molecular formula of ChemDiv1_006098?
The molecular formula of ChemDiv1_006098 is C23H16Cl2N2O4.
What is the molecular weight of ChemDiv1_006098?
The molecular weight of ChemDiv1_006098 is 454.05 g/mol.
Where can I buy ChemDiv1_006098?
You can request a quote for ChemDiv1_006098 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_006098?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_006098 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.