BAS 06856147
TL;DR: BAS 06856147 (CAS 642432-31-3) is a chemical compound with molecular formula C21H15ClN4O3 and molecular weight 406.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(6-chloro-2-phenylbenzotriazol-5-yl)-2,3-dihydro-1,4-benzodioxine-6-carboxamide
Also Known As: BAS 06856147, AP-970/42166118, N-(6-chloro-2-phenyl-2H-1,2,3-benzotriazol-5-yl)-2,3-dihydro-1,4-benzodioxine-6-carboxamide, N-(6-chloro-2-phenylbenzotriazol-5-yl)-2,3-dihydro-1,4-benzodioxine-6-carboxamide, N-(6-chloro-2-phenyl-2H-benzotriazol-5-yl)-2,3-dihydro-1,4-benzodioxine-6-carboxamide
| Molecular Formula | C21H15ClN4O3 |
|---|---|
| Molecular Weight | 406.08 g/mol |
| LogP | 4.0974 |
| Topological Polar Surface Area | 78.27 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 406.08328 |
| Heavy Atoms | 29 |
| Complexity | 1223.5637 |
Chemical Identifiers
| CAS Number | 642432-31-3 |
|---|---|
| SMILES | C1COC2=C(O1)C=CC(=C2)C(=O)NC3=CC4=NN(N=C4C=C3Cl)C5=CC=CC=C5 |
Product Overview
BAS 06856147 (CAS 642432-31-3), with molecular formula C21H15ClN4O3 and molecular weight 406.08 g/mol. IUPAC: N-(6-chloro-2-phenylbenzotriazol-5-yl)-2,3-dihydro-1,4-benzodioxine-6-carboxamide.
Chemical Property Profile of BAS 06856147
Property Insights of BAS 06856147
The XLogP value of 4.0974 indicates that BAS 06856147 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.27 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 06856147. Following Lipinski's Rule of Five, BAS 06856147 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 BAS 06856147?
The CAS number of BAS 06856147 is 642432-31-3.
What is the molecular formula of BAS 06856147?
The molecular formula of BAS 06856147 is C21H15ClN4O3.
What is the molecular weight of BAS 06856147?
The molecular weight of BAS 06856147 is 406.08 g/mol.
Where can I buy BAS 06856147?
You can request a quote for BAS 06856147 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 06856147?
Yes, KEHONG BIO provides custom synthesis services for BAS 06856147 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.