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N-allyl-3-chloropyrazolo[1,5-a]pyrimidine-2-carboxamide
TL;DR: N-allyl-3-chloropyrazolo[1,5-a]pyrimidine-2-carboxamide (CAS 676522-32-0) is a chemical compound with molecular formula C10H9ClN4O and molecular weight 236.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-N-prop-2-enylpyrazolo[1,5-a]pyrimidine-2-carboxamide
Also Known As: SDCCGMLS-0047212.P002, N-allyl-3-chloropyrazolo[1,5-a]pyrimidine-2-carboxamide, 3-chloro-N-prop-2-enylpyrazolo[1,5-a]pyrimidine-2-carboxamide, 3-chloro-N-(prop-2-en-1-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
| Molecular Formula | C10H9ClN4O |
|---|---|
| Molecular Weight | 236.05 g/mol |
| LogP | 1.2985 |
| Topological Polar Surface Area | 59.29 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 236.0465 |
| Heavy Atoms | 16 |
| Complexity | 548.7427 |
Chemical Identifiers
| CAS Number | 676522-32-0 |
|---|---|
| SMILES | C=CCNC(=O)C1=NN2C=CC=NC2=C1Cl |
Product Overview
N-allyl-3-chloropyrazolo[1,5-a]pyrimidine-2-carboxamide (CAS 676522-32-0), with molecular formula C10H9ClN4O and molecular weight 236.05 g/mol. IUPAC: 3-chloro-N-prop-2-enylpyrazolo[1,5-a]pyrimidine-2-carboxamide.
Chemical Property Profile of N-allyl-3-chloropyrazolo[1,5-a]pyrimidine-2-carboxamide
Property Insights of N-allyl-3-chloropyrazolo[1,5-a]pyrimidine-2-carboxamide
The XLogP value of 1.2985 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-allyl-3-chloropyrazolo[1,5-a]pyrimidine-2-carboxamide. With a topological polar surface area (TPSA) of 59.29 Ų, N-allyl-3-chloropyrazolo[1,5-a]pyrimidine-2-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-allyl-3-chloropyrazolo[1,5-a]pyrimidine-2-carboxamide has 1 hydrogen bond donor(s) and 3 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 N-allyl-3-chloropyrazolo[1,5-a]pyrimidine-2-carboxamide?
The CAS number of N-allyl-3-chloropyrazolo[1,5-a]pyrimidine-2-carboxamide is 676522-32-0.
What is the molecular formula of N-allyl-3-chloropyrazolo[1,5-a]pyrimidine-2-carboxamide?
The molecular formula of N-allyl-3-chloropyrazolo[1,5-a]pyrimidine-2-carboxamide is C10H9ClN4O.
What is the molecular weight of N-allyl-3-chloropyrazolo[1,5-a]pyrimidine-2-carboxamide?
The molecular weight of N-allyl-3-chloropyrazolo[1,5-a]pyrimidine-2-carboxamide is 236.05 g/mol.
Where can I buy N-allyl-3-chloropyrazolo[1,5-a]pyrimidine-2-carboxamide?
You can request a quote for N-allyl-3-chloropyrazolo[1,5-a]pyrimidine-2-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-allyl-3-chloropyrazolo[1,5-a]pyrimidine-2-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-allyl-3-chloropyrazolo[1,5-a]pyrimidine-2-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.