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Benzoic acid, 5-[[(butylamino)carbonyl]amino]-2-hydroxy-
TL;DR: Benzoic acid, 5-[[(butylamino)carbonyl]amino]-2-hydroxy- (CAS 501678-20-2) is a chemical compound with molecular formula C12H16N2O4 and molecular weight 252.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(butylcarbamoylamino)-2-hydroxybenzoic acid
Also Known As: 5-(butylcarbamoylamino)-2-hydroxybenzoic acid, 2-Hydroxy-5-(3-butylureido)benzoic acid, Benzoic acid, 5-[[(butylamino)carbonyl]amino]-2-hydroxy-, J3.532.186A, 4-(o-anisidino)-1-(tert-butoxycarbonyl)piperidine
| Molecular Formula | C12H16N2O4 |
|---|---|
| Molecular Weight | 252.11 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 98.7 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 252.11101 |
| Heavy Atoms | 18 |
| Complexity | 296.0 |
Chemical Identifiers
| CAS Number | 501678-20-2 |
|---|---|
| SMILES | CCCCNC(=O)NC1=CC(=C(C=C1)O)C(=O)O |
| InChIKey | RWKWKMQNLHLVPH-UHFFFAOYSA-N |
Product Overview
Benzoic acid, 5-[[(butylamino)carbonyl]amino]-2-hydroxy- (CAS 501678-20-2), with molecular formula C12H16N2O4 and molecular weight 252.11 g/mol. IUPAC: 5-(butylcarbamoylamino)-2-hydroxybenzoic acid.
Chemical Property Profile of Benzoic acid, 5-[[(butylamino)carbonyl]amino]-2-hydroxy-
Property Insights of Benzoic acid, 5-[[(butylamino)carbonyl]amino]-2-hydroxy-
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzoic acid, 5-[[(butylamino)carbonyl]amino]-2-hydroxy-. The TPSA of 98.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzoic acid, 5-[[(butylamino)carbonyl]amino]-2-hydroxy-. Following Lipinski's Rule of Five, Benzoic acid, 5-[[(butylamino)carbonyl]amino]-2-hydroxy- has 4 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 Benzoic acid, 5-[[(butylamino)carbonyl]amino]-2-hydroxy-?
The CAS number of Benzoic acid, 5-[[(butylamino)carbonyl]amino]-2-hydroxy- is 501678-20-2.
What is the molecular formula of Benzoic acid, 5-[[(butylamino)carbonyl]amino]-2-hydroxy-?
The molecular formula of Benzoic acid, 5-[[(butylamino)carbonyl]amino]-2-hydroxy- is C12H16N2O4.
What is the molecular weight of Benzoic acid, 5-[[(butylamino)carbonyl]amino]-2-hydroxy-?
The molecular weight of Benzoic acid, 5-[[(butylamino)carbonyl]amino]-2-hydroxy- is 252.11 g/mol.
Where can I buy Benzoic acid, 5-[[(butylamino)carbonyl]amino]-2-hydroxy-?
You can request a quote for Benzoic acid, 5-[[(butylamino)carbonyl]amino]-2-hydroxy- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoic acid, 5-[[(butylamino)carbonyl]amino]-2-hydroxy-?
Yes, KEHONG BIO provides custom synthesis services for Benzoic acid, 5-[[(butylamino)carbonyl]amino]-2-hydroxy- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.