AB00668009-01
TL;DR: AB00668009-01 (CAS 393821-93-7) is a chemical compound with molecular formula C16H19ClN6 and molecular weight 330.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[1-(4-chlorophenyl)pyrazolo[3,4-d]pyrimidin-4-yl]-N',N'-dimethylpropane-1,3-diamine
Also Known As: AB00668009-01, F0521-0118, 1-(4-chlorophenyl)-N-[3-(dimethylamino)propyl]-1H-pyrazolo[3,4-d]pyrimidin-4-amine, N'-[1-(4-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-N,N-dimethylpropane-1,3-diamine, N1-(1-(4-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-N3,N3-dimethylpropane-1,3-diamine
| Molecular Formula | C16H19ClN6 |
|---|---|
| Molecular Weight | 330.14 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 58.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 330.136 |
| Heavy Atoms | 23 |
| Complexity | 360.0 |
Chemical Identifiers
| CAS Number | 393821-93-7 |
|---|---|
| SMILES | CN(C)CCCNC1=C2C=NN(C2=NC=N1)C3=CC=C(C=C3)Cl |
| InChIKey | ORUVPDSOJMKLRQ-UHFFFAOYSA-N |
Product Overview
AB00668009-01 (CAS 393821-93-7), with molecular formula C16H19ClN6 and molecular weight 330.14 g/mol. IUPAC: N-[1-(4-chlorophenyl)pyrazolo[3,4-d]pyrimidin-4-yl]-N',N'-dimethylpropane-1,3-diamine.
Chemical Property Profile of AB00668009-01
Property Insights of AB00668009-01
The XLogP value of 3.2 indicates that AB00668009-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.9 Ų, AB00668009-01 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AB00668009-01 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 AB00668009-01?
The CAS number of AB00668009-01 is 393821-93-7.
What is the molecular formula of AB00668009-01?
The molecular formula of AB00668009-01 is C16H19ClN6.
What is the molecular weight of AB00668009-01?
The molecular weight of AB00668009-01 is 330.14 g/mol.
Where can I buy AB00668009-01?
You can request a quote for AB00668009-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00668009-01?
Yes, KEHONG BIO provides custom synthesis services for AB00668009-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.