1-甲基-N-(苯甲基)-1H-四唑-5-胺
TL;DR: 1-甲基-N-(苯甲基)-1H-四唑-5-胺 (CAS 39900-53-3) is a chemical compound with molecular formula C9H11N5 and molecular weight 189.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-甲基-N-(苯甲基)-1H-四唑-5-胺
N-benzyl-1-methyltetrazol-5-amine
Also Known As: n-benzyl-1-methyl-1h-tetrazol-5-amine, 5-Benzylamino-1-methyltetrazole, N-benzyl-1-methyltetrazol-5-amine, BAS 00633641, 1H-Tetrazol-5-amine, 1-methyl-N-(phenylmethyl)-
| Molecular Formula | C9H11N5 |
|---|---|
| Molecular Weight | 189.10 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 55.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 189.10144 |
| Heavy Atoms | 14 |
| Complexity | 169.0 |
Chemical Identifiers
| CAS Number | 39900-53-3 |
|---|---|
| SMILES | CN1C(=NN=N1)NCC2=CC=CC=C2 |
| InChIKey | UPTLFEOYVRFYJA-UHFFFAOYSA-N |
Product Overview
1-甲基-N-(苯甲基)-1H-四唑-5-胺 (CAS 39900-53-3), with molecular formula C9H11N5 and molecular weight 189.10 g/mol. IUPAC: N-benzyl-1-methyltetrazol-5-amine.
Chemical Property Profile of 1-甲基-N-(苯甲基)-1H-四唑-5-胺
Property Insights of 1-甲基-N-(苯甲基)-1H-四唑-5-胺
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-甲基-N-(苯甲基)-1H-四唑-5-胺. With a topological polar surface area (TPSA) of 55.6 Ų, 1-甲基-N-(苯甲基)-1H-四唑-5-胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-甲基-N-(苯甲基)-1H-四唑-5-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-甲基-N-(苯甲基)-1H-四唑-5-胺?
The CAS number of 1-甲基-N-(苯甲基)-1H-四唑-5-胺 is 39900-53-3.
What is the molecular formula of 1-甲基-N-(苯甲基)-1H-四唑-5-胺?
The molecular formula of 1-甲基-N-(苯甲基)-1H-四唑-5-胺 is C9H11N5.
What is the molecular weight of 1-甲基-N-(苯甲基)-1H-四唑-5-胺?
The molecular weight of 1-甲基-N-(苯甲基)-1H-四唑-5-胺 is 189.10 g/mol.
Where can I buy 1-甲基-N-(苯甲基)-1H-四唑-5-胺?
You can request a quote for 1-甲基-N-(苯甲基)-1H-四唑-5-胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-甲基-N-(苯甲基)-1H-四唑-5-胺?
Yes, KEHONG BIO provides custom synthesis services for 1-甲基-N-(苯甲基)-1H-四唑-5-胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.