AB00677621-01
TL;DR: AB00677621-01 (CAS 890943-91-6) is a chemical compound with molecular formula C21H19ClN6O and molecular weight 406.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N'-[1-(3-chloro-4-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]-3-phenylpropanehydrazide
Also Known As: AB00677621-01, F1887-0337, N'-[1-(3-chloro-4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-3-phenylpropanehydrazide, N'-[1-(3-chloro-4-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]-3-phenylpropanehydrazide, N-{[1-(3-chloro-4-methylphenyl)pyrazolo[4,5-e]pyrimidin-4-yl]amino}-3-phenylpr opanamide
| Molecular Formula | C21H19ClN6O |
|---|---|
| Molecular Weight | 406.13 g/mol |
| LogP | 3.85322 |
| Topological Polar Surface Area | 84.73 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 406.1309 |
| Heavy Atoms | 29 |
| Complexity | 1158.525 |
Chemical Identifiers
| CAS Number | 890943-91-6 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)N2C3=NC=NC(=C3C=N2)NNC(=O)CCC4=CC=CC=C4)Cl |
Product Overview
AB00677621-01 (CAS 890943-91-6), with molecular formula C21H19ClN6O and molecular weight 406.13 g/mol. IUPAC: N'-[1-(3-chloro-4-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]-3-phenylpropanehydrazide.
Chemical Property Profile of AB00677621-01
Property Insights of AB00677621-01
The XLogP value of 3.85322 indicates that AB00677621-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.73 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00677621-01. Following Lipinski's Rule of Five, AB00677621-01 has 2 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 AB00677621-01?
The CAS number of AB00677621-01 is 890943-91-6.
What is the molecular formula of AB00677621-01?
The molecular formula of AB00677621-01 is C21H19ClN6O.
What is the molecular weight of AB00677621-01?
The molecular weight of AB00677621-01 is 406.13 g/mol.
Where can I buy AB00677621-01?
You can request a quote for AB00677621-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00677621-01?
Yes, KEHONG BIO provides custom synthesis services for AB00677621-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.