C14H14ClN9O
TL;DR: C14H14ClN9O (CAS 384801-31-4) is a chemical compound with molecular formula C14H14ClN9O and molecular weight 359.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(5-aminotetrazol-1-yl)-N-[(E)-(5-chloro-3-methyl-1-phenylpyrazol-4-yl)methylideneamino]acetamide
Also Known As: (E)-2-(5-amino-1H-tetrazol-1-yl)-N'-((5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylene)acetohydrazide
| Molecular Formula | C14H14ClN9O |
|---|---|
| Molecular Weight | 359.10 g/mol |
| LogP | 0.55312 |
| Topological Polar Surface Area | 128.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 359.10098 |
| Heavy Atoms | 25 |
| Complexity | 915.7878 |
Chemical Identifiers
| CAS Number | 384801-31-4 |
|---|---|
| SMILES | CC1=NN(C(=C1/C=N/NC(=O)CN2C(=NN=N2)N)Cl)C3=CC=CC=C3 |
Product Overview
C14H14ClN9O (CAS 384801-31-4), with molecular formula C14H14ClN9O and molecular weight 359.10 g/mol. IUPAC: 2-(5-aminotetrazol-1-yl)-N-[(E)-(5-chloro-3-methyl-1-phenylpyrazol-4-yl)methylideneamino]acetamide.
Chemical Property Profile of C14H14ClN9O
Property Insights of C14H14ClN9O
The XLogP value of 0.55312 suggests moderate lipophilicity, balancing water solubility and membrane permeability for C14H14ClN9O. The TPSA of 128.9 Ų falls within the moderate polarity range, balancing permeability and solubility for C14H14ClN9O. Following Lipinski's Rule of Five, C14H14ClN9O has 2 hydrogen bond donor(s) and 7 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 C14H14ClN9O?
The CAS number of C14H14ClN9O is 384801-31-4.
What is the molecular formula of C14H14ClN9O?
The molecular formula of C14H14ClN9O is C14H14ClN9O.
What is the molecular weight of C14H14ClN9O?
The molecular weight of C14H14ClN9O is 359.10 g/mol.
Where can I buy C14H14ClN9O?
You can request a quote for C14H14ClN9O directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C14H14ClN9O?
Yes, KEHONG BIO provides custom synthesis services for C14H14ClN9O and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.