![methyl 4-({[2-(1H-tetrazol-1-yl)phenyl]carbonyl}amino)benzoate structure](/static/products/101/1010881-98-7.webp)
methyl 4-({[2-(1H-tetrazol-1-yl)phenyl]carbonyl}amino)benzoate
TL;DR: methyl 4-({[2-(1H-tetrazol-1-yl)phenyl]carbonyl}amino)benzoate (CAS 1010881-98-7) is a chemical compound with molecular formula C16H13N5O3 and molecular weight 323.10184 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 4-[[2-(tetrazol-1-yl)benzoyl]amino]benzoate
Also Known As: methyl 4-(2-(1H-tetrazol-1-yl)benzamido)benzoate, methyl 4-[[2-(tetrazol-1-yl)benzoyl]amino]benzoate, methyl 4-({[2-(1H-tetrazol-1-yl)phenyl]carbonyl}amino)benzoate
Technical Specifications
| Molecular Formula | C16H13N5O3 |
| Molecular Weight | 323.10184 g/mol |
| XLogP | 1.9 |
| Topological Polar Surface Area (TPSA) | 99.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 323.10184 Da |
| Heavy Atoms | 24 |
| Complexity | 453.0 |
| SMILES | COC(=O)C1=CC=C(C=C1)NC(=O)C2=CC=CC=C2N3C=NN=N3 |
| InChIKey | YUHOAYJXODTNKG-UHFFFAOYSA-N |
Chemical Property Profile of methyl 4-({[2-(1H-tetrazol-1-yl)phenyl]carbonyl}amino)benzoate
Property Insights of methyl 4-({[2-(1H-tetrazol-1-yl)phenyl]carbonyl}amino)benzoate
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl 4-({[2-(1H-tetrazol-1-yl)phenyl]carbonyl}amino)benzoate. The TPSA of 99.0 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 4-({[2-(1H-tetrazol-1-yl)phenyl]carbonyl}amino)benzoate. Following Lipinski's Rule of Five, methyl 4-({[2-(1H-tetrazol-1-yl)phenyl]carbonyl}amino)benzoate has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of methyl 4-({[2-(1H-tetrazol-1-yl)phenyl]carbonyl}amino)benzoate?
The CAS number of methyl 4-({[2-(1H-tetrazol-1-yl)phenyl]carbonyl}amino)benzoate is 1010881-98-7.
What is the molecular formula of methyl 4-({[2-(1H-tetrazol-1-yl)phenyl]carbonyl}amino)benzoate?
The molecular formula of methyl 4-({[2-(1H-tetrazol-1-yl)phenyl]carbonyl}amino)benzoate is C16H13N5O3.
What is the molecular weight of methyl 4-({[2-(1H-tetrazol-1-yl)phenyl]carbonyl}amino)benzoate?
The molecular weight of methyl 4-({[2-(1H-tetrazol-1-yl)phenyl]carbonyl}amino)benzoate is 323.10184 g/mol.
Where can I buy methyl 4-({[2-(1H-tetrazol-1-yl)phenyl]carbonyl}amino)benzoate?
You can request a quote for methyl 4-({[2-(1H-tetrazol-1-yl)phenyl]carbonyl}amino)benzoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for methyl 4-({[2-(1H-tetrazol-1-yl)phenyl]carbonyl}amino)benzoate?
Yes, CoreyChem provides custom synthesis services for methyl 4-({[2-(1H-tetrazol-1-yl)phenyl]carbonyl}amino)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.