![2-[(2-氨甲酰硫基乙酰基)氨基]苯甲酸 structure](/static/products/1020/102089-50-9.webp)
2-[(2-氨甲酰硫基乙酰基)氨基]苯甲酸
TL;DR: 2-[(2-氨甲酰硫基乙酰基)氨基]苯甲酸 (CAS 102089-50-9) is a chemical compound with molecular formula C10H10N2O4S and molecular weight 254.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2-氨甲酰硫基乙酰基)氨基]苯甲酸
2-[(2-carbamoylsulfanylacetyl)amino]benzoic acid
Also Known As: 4leg, 2-[(2-carbamoylsulfanylacetyl)amino]benzoic acid, 2-{[(carbamoylsulfanyl)acetyl]amino}benzoic acid, 2-((2-carbamoylsulfanylacetyl)amino)benzoic acid, 2-[[2-(carbamoylthio)-1-oxoethyl]amino]benzoic acid
| Molecular Formula | C10H10N2O4S |
|---|---|
| Molecular Weight | 254.04 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 135.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 254.03613 |
| Heavy Atoms | 17 |
| Complexity | 321.0 |
Chemical Identifiers
| CAS Number | 102089-50-9 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C(=O)O)NC(=O)CSC(=O)N |
| InChIKey | NWUAPELPCMQTDN-UHFFFAOYSA-N |
Product Overview
2-[(2-氨甲酰硫基乙酰基)氨基]苯甲酸 (CAS 102089-50-9), with molecular formula C10H10N2O4S and molecular weight 254.04 g/mol. IUPAC: 2-[(2-carbamoylsulfanylacetyl)amino]benzoic acid.
Chemical Property Profile of 2-[(2-氨甲酰硫基乙酰基)氨基]苯甲酸
Property Insights of 2-[(2-氨甲酰硫基乙酰基)氨基]苯甲酸
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(2-氨甲酰硫基乙酰基)氨基]苯甲酸. The TPSA of 135.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(2-氨甲酰硫基乙酰基)氨基]苯甲酸. Following Lipinski's Rule of Five, 2-[(2-氨甲酰硫基乙酰基)氨基]苯甲酸 has 3 hydrogen bond donor(s) and 5 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 2-[(2-氨甲酰硫基乙酰基)氨基]苯甲酸?
The CAS number of 2-[(2-氨甲酰硫基乙酰基)氨基]苯甲酸 is 102089-50-9.
What is the molecular formula of 2-[(2-氨甲酰硫基乙酰基)氨基]苯甲酸?
The molecular formula of 2-[(2-氨甲酰硫基乙酰基)氨基]苯甲酸 is C10H10N2O4S.
What is the molecular weight of 2-[(2-氨甲酰硫基乙酰基)氨基]苯甲酸?
The molecular weight of 2-[(2-氨甲酰硫基乙酰基)氨基]苯甲酸 is 254.04 g/mol.
Where can I buy 2-[(2-氨甲酰硫基乙酰基)氨基]苯甲酸?
You can request a quote for 2-[(2-氨甲酰硫基乙酰基)氨基]苯甲酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(2-氨甲酰硫基乙酰基)氨基]苯甲酸?
Yes, KEHONG BIO provides custom synthesis services for 2-[(2-氨甲酰硫基乙酰基)氨基]苯甲酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.