![Benzenamine, 4-[(4-bromo-1H-pyrazol-1-yl)methyl]- structure](/static/products/5128/512809-49-3.webp)
Benzenamine, 4-[(4-bromo-1H-pyrazol-1-yl)methyl]-
TL;DR: Benzenamine, 4-[(4-bromo-1H-pyrazol-1-yl)methyl]- (CAS 512809-49-3) is a chemical compound with molecular formula C10H10BrN3 and molecular weight 251.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(4-bromopyrazol-1-yl)methyl]aniline
Also Known As: 4-[(4-bromo-1H-pyrazol-1-yl)methyl]aniline, 4-(4-Bromo-pyrazol-1-ylmethyl)-phenylamine, 4-[(4-bromopyrazol-1-yl)methyl]aniline, 4-((4-Bromo-1H-pyrazol-1-yl)methyl)aniline, 4-[(4-bromopyrazolyl)methyl]phenylamine
| Molecular Formula | C10H10BrN3 |
|---|---|
| Molecular Weight | 251.01 g/mol |
| LogP | 2.2761 |
| Topological Polar Surface Area | 43.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 251.00581 |
| Heavy Atoms | 14 |
| Complexity | 419.18707 |
Chemical Identifiers
| CAS Number | 512809-49-3 |
|---|---|
| SMILES | C1=CC(=CC=C1CN2C=C(C=N2)Br)N |
Product Overview
Benzenamine, 4-[(4-bromo-1H-pyrazol-1-yl)methyl]- (CAS 512809-49-3), with molecular formula C10H10BrN3 and molecular weight 251.01 g/mol. IUPAC: 4-[(4-bromopyrazol-1-yl)methyl]aniline.
Chemical Property Profile of Benzenamine, 4-[(4-bromo-1H-pyrazol-1-yl)methyl]-
Property Insights of Benzenamine, 4-[(4-bromo-1H-pyrazol-1-yl)methyl]-
The XLogP value of 2.2761 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzenamine, 4-[(4-bromo-1H-pyrazol-1-yl)methyl]-. With a topological polar surface area (TPSA) of 43.84 Ų, Benzenamine, 4-[(4-bromo-1H-pyrazol-1-yl)methyl]- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzenamine, 4-[(4-bromo-1H-pyrazol-1-yl)methyl]- has 1 hydrogen bond donor(s) and 2 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 Benzenamine, 4-[(4-bromo-1H-pyrazol-1-yl)methyl]-?
The CAS number of Benzenamine, 4-[(4-bromo-1H-pyrazol-1-yl)methyl]- is 512809-49-3.
What is the molecular formula of Benzenamine, 4-[(4-bromo-1H-pyrazol-1-yl)methyl]-?
The molecular formula of Benzenamine, 4-[(4-bromo-1H-pyrazol-1-yl)methyl]- is C10H10BrN3.
What is the molecular weight of Benzenamine, 4-[(4-bromo-1H-pyrazol-1-yl)methyl]-?
The molecular weight of Benzenamine, 4-[(4-bromo-1H-pyrazol-1-yl)methyl]- is 251.01 g/mol.
Where can I buy Benzenamine, 4-[(4-bromo-1H-pyrazol-1-yl)methyl]-?
You can request a quote for Benzenamine, 4-[(4-bromo-1H-pyrazol-1-yl)methyl]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzenamine, 4-[(4-bromo-1H-pyrazol-1-yl)methyl]-?
Yes, KEHONG BIO provides custom synthesis services for Benzenamine, 4-[(4-bromo-1H-pyrazol-1-yl)methyl]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.