N(3)-(氯乙酰基)-2,3-二氨基丙酸
TL;DR: N(3)-(氯乙酰基)-2,3-二氨基丙酸 (CAS 135630-95-4) is a chemical compound with molecular formula C5H9ClN2O3 and molecular weight 180.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N(3)-(氯乙酰基)-2,3-二氨基丙酸
(2S)-2-amino-3-[(2-chloroacetyl)amino]propanoic acid
Also Known As: CADPA, 3-[(chloroacetyl)amino]-L-alanine, (2S)-2-amino-3-[(2-chloroacetyl)amino]propanoic acid, N(3)-Chloroacetyl-2,3-diaminopropanoic acid, N(3)-(Chloroacetyl)-2,3-diaminopropanoic acid
| Molecular Formula | C5H9ClN2O3 |
|---|---|
| Molecular Weight | 180.03 g/mol |
| LogP | -3.4 |
| Topological Polar Surface Area | 92.4 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 180.03017 |
| Heavy Atoms | 11 |
| Complexity | 162.0 |
Chemical Identifiers
| CAS Number | 135630-95-4 |
|---|---|
| SMILES | C([C@@H](C(=O)O)N)NC(=O)CCl |
| InChIKey | FOJRYNHRKWPSMC-VKHMYHEASA-N |
Product Overview
N(3)-(氯乙酰基)-2,3-二氨基丙酸 (CAS 135630-95-4), with molecular formula C5H9ClN2O3 and molecular weight 180.03 g/mol. IUPAC: (2S)-2-amino-3-[(2-chloroacetyl)amino]propanoic acid.
Chemical Property Profile of N(3)-(氯乙酰基)-2,3-二氨基丙酸
Property Insights of N(3)-(氯乙酰基)-2,3-二氨基丙酸
The XLogP value of -3.4 indicates that N(3)-(氯乙酰基)-2,3-二氨基丙酸 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 92.4 Ų falls within the moderate polarity range, balancing permeability and solubility for N(3)-(氯乙酰基)-2,3-二氨基丙酸. Following Lipinski's Rule of Five, N(3)-(氯乙酰基)-2,3-二氨基丙酸 has 3 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 N(3)-(氯乙酰基)-2,3-二氨基丙酸?
The CAS number of N(3)-(氯乙酰基)-2,3-二氨基丙酸 is 135630-95-4.
What is the molecular formula of N(3)-(氯乙酰基)-2,3-二氨基丙酸?
The molecular formula of N(3)-(氯乙酰基)-2,3-二氨基丙酸 is C5H9ClN2O3.
What is the molecular weight of N(3)-(氯乙酰基)-2,3-二氨基丙酸?
The molecular weight of N(3)-(氯乙酰基)-2,3-二氨基丙酸 is 180.03 g/mol.
Where can I buy N(3)-(氯乙酰基)-2,3-二氨基丙酸?
You can request a quote for N(3)-(氯乙酰基)-2,3-二氨基丙酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N(3)-(氯乙酰基)-2,3-二氨基丙酸?
Yes, KEHONG BIO provides custom synthesis services for N(3)-(氯乙酰基)-2,3-二氨基丙酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.