![1-叔丁基-3-对甲苯基-1H-吡唑并[3,4-d]嘧啶-4-胺 structure](/static/products/1728/172889-26-8.webp)
1-叔丁基-3-对甲苯基-1H-吡唑并[3,4-d]嘧啶-4-胺
TL;DR: 1-叔丁基-3-对甲苯基-1H-吡唑并[3,4-d]嘧啶-4-胺 (CAS 172889-26-8) is a chemical compound with molecular formula C16H19N5 and molecular weight 281.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-叔丁基-3-对甲苯基-1H-吡唑并[3,4-d]嘧啶-4-胺
1-tert-butyl-3-(4-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-amine
Also Known As: PP1, PP 1, 4fev, PP1 cpd, PYRAZOLOPYRIMIDINE 1
| Molecular Formula | C16H19N5 |
|---|---|
| Molecular Weight | 281.16 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 69.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 281.16403 |
| Heavy Atoms | 21 |
| Complexity | 358.0 |
Chemical Identifiers
| CAS Number | 172889-26-8 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2=NN(C3=NC=NC(=C23)N)C(C)(C)C |
| InChIKey | ZVPDNRVYHLRXLX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-叔丁基-3-对甲苯基-1H-吡唑并[3,4-d]嘧啶-4-胺 (CAS 172889-26-8), with molecular formula C16H19N5 and molecular weight 281.16 g/mol. IUPAC: 1-tert-butyl-3-(4-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-amine.
Chemical Property Profile of 1-叔丁基-3-对甲苯基-1H-吡唑并[3,4-d]嘧啶-4-胺
Property Insights of 1-叔丁基-3-对甲苯基-1H-吡唑并[3,4-d]嘧啶-4-胺
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-叔丁基-3-对甲苯基-1H-吡唑并[3,4-d]嘧啶-4-胺. The TPSA of 69.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-叔丁基-3-对甲苯基-1H-吡唑并[3,4-d]嘧啶-4-胺. Following Lipinski's Rule of Five, 1-叔丁基-3-对甲苯基-1H-吡唑并[3,4-d]嘧啶-4-胺 has 1 hydrogen bond donor(s) and 4 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 1-叔丁基-3-对甲苯基-1H-吡唑并[3,4-d]嘧啶-4-胺?
The CAS number of 1-叔丁基-3-对甲苯基-1H-吡唑并[3,4-d]嘧啶-4-胺 is 172889-26-8.
What is the molecular formula of 1-叔丁基-3-对甲苯基-1H-吡唑并[3,4-d]嘧啶-4-胺?
The molecular formula of 1-叔丁基-3-对甲苯基-1H-吡唑并[3,4-d]嘧啶-4-胺 is C16H19N5.
What is the molecular weight of 1-叔丁基-3-对甲苯基-1H-吡唑并[3,4-d]嘧啶-4-胺?
The molecular weight of 1-叔丁基-3-对甲苯基-1H-吡唑并[3,4-d]嘧啶-4-胺 is 281.16 g/mol.
Where can I buy 1-叔丁基-3-对甲苯基-1H-吡唑并[3,4-d]嘧啶-4-胺?
You can request a quote for 1-叔丁基-3-对甲苯基-1H-吡唑并[3,4-d]嘧啶-4-胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-叔丁基-3-对甲苯基-1H-吡唑并[3,4-d]嘧啶-4-胺?
Yes, KEHONG BIO provides custom synthesis services for 1-叔丁基-3-对甲苯基-1H-吡唑并[3,4-d]嘧啶-4-胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.