A3542/0150121
TL;DR: A3542/0150121 (CAS 627889-60-5) is a chemical compound with molecular formula C22H17Cl2N3O and molecular weight 409.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7,9-dichloro-2-(4-methylphenyl)-5-pyridin-4-yl-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazine
Also Known As: A3542/0150121, 7,9-DICHLORO-2-(4-METHYLPHENYL)-5-(4-PYRIDYL)-1,10B-DIHYDROPYRAZOLO[1,5-C][1,3]BENZOXAZINE, 7,9-dichloro-2-(4-methylphenyl)-5-(pyridin-4-yl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine, 7,9-dichloro-2-(4-methylphenyl)-5-pyridin-4-yl-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazine, 7,9-dichloro-5-(pyridin-4-yl)-2-(p-tolyl)-5,10b-dihydro-1H-benzo[e]pyrazolo[1,5-c][1,3]oxazine
| Molecular Formula | C22H17Cl2N3O |
|---|---|
| Molecular Weight | 409.07 g/mol |
| LogP | 5.93912 |
| Topological Polar Surface Area | 37.72 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 409.07486 |
| Heavy Atoms | 28 |
| Complexity | 1067.1449 |
Chemical Identifiers
| CAS Number | 627889-60-5 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2=NN3C(C2)C4=C(C(=CC(=C4)Cl)Cl)OC3C5=CC=NC=C5 |
Product Overview
A3542/0150121 (CAS 627889-60-5), with molecular formula C22H17Cl2N3O and molecular weight 409.07 g/mol. IUPAC: 7,9-dichloro-2-(4-methylphenyl)-5-pyridin-4-yl-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazine.
Chemical Property Profile of A3542/0150121
Property Insights of A3542/0150121
The XLogP value of 5.93912 indicates that A3542/0150121 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.72 Ų, A3542/0150121 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, A3542/0150121 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of A3542/0150121?
The CAS number of A3542/0150121 is 627889-60-5.
What is the molecular formula of A3542/0150121?
The molecular formula of A3542/0150121 is C22H17Cl2N3O.
What is the molecular weight of A3542/0150121?
The molecular weight of A3542/0150121 is 409.07 g/mol.
Where can I buy A3542/0150121?
You can request a quote for A3542/0150121 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3542/0150121?
Yes, KEHONG BIO provides custom synthesis services for A3542/0150121 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.