L-Prolinamide, N-(carboxymethyl)-beta-phenyl-D-phenylalanyl-N-((5-(aminoiminomethyl)-2-thienyl)methyl)-
TL;DR: L-Prolinamide, N-(carboxymethyl)-beta-phenyl-D-phenylalanyl-N-((5-(aminoiminomethyl)-2-thienyl)methyl)- (CAS 280780-95-2) is a chemical compound with molecular formula C28H31N5O4S and molecular weight 533.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[(2R)-1-[(2S)-2-[(5-carbamimidoylthiophen-2-yl)methylcarbamoyl]pyrrolidin-1-yl]-1-oxo-3,3-diphenylpropan-2-yl]amino]acetic acid
Also Known As: L-Prolinamide, N-(carboxymethyl)-beta-phenyl-D-phenylalanyl-N-((5-(aminoiminomethyl)-2-thienyl)methyl)-, (1-Benzhydryl-2-{2-[(5-carbamimidoyl-thiophen-2-ylmethyl)-carbamoyl]-pyrrolidin-1-yl}-2-oxo-ethylamino)-acetic acid, L-PROLINAMIDE, N-(CARBOXYMETHYL)-.BETA.-PHENYL-D-PHENYLALANYL-N-((5-(AMINOIMINOMETHYL)-2-THIENYL)METHYL)-, RefChem:152593
| Molecular Formula | C28H31N5O4S |
|---|---|
| Molecular Weight | 533.21 g/mol |
| LogP | 2.51427 |
| Topological Polar Surface Area | 148.61 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 11 |
| Exact Mass | 533.20966 |
| Heavy Atoms | 38 |
| Complexity | 1241.1656 |
Chemical Identifiers
| CAS Number | 280780-95-2 |
|---|---|
| SMILES | C1C[C@H](N(C1)C(=O)[C@@H](C(C2=CC=CC=C2)C3=CC=CC=C3)NCC(=O)O)C(=O)NCC4=CC=C(S4)C(=N)N |
Product Overview
L-Prolinamide, N-(carboxymethyl)-beta-phenyl-D-phenylalanyl-N-((5-(aminoiminomethyl)-2-thienyl)methyl)- (CAS 280780-95-2), with molecular formula C28H31N5O4S and molecular weight 533.21 g/mol. IUPAC: 2-[[(2R)-1-[(2S)-2-[(5-carbamimidoylthiophen-2-yl)methylcarbamoyl]pyrrolidin-1-yl]-1-oxo-3,3-diphenylpropan-2-yl]amino]acetic acid.
Chemical Property Profile of L-Prolinamide, N-(carboxymethyl)-beta-phenyl-D-phenylalanyl-N-((5-(aminoiminomethyl)-2-thienyl)methyl)-
Property Insights of L-Prolinamide, N-(carboxymethyl)-beta-phenyl-D-phenylalanyl-N-((5-(aminoiminomethyl)-2-thienyl)methyl)-
The XLogP value of 2.51427 suggests moderate lipophilicity, balancing water solubility and membrane permeability for L-Prolinamide, N-(carboxymethyl)-beta-phenyl-D-phenylalanyl-N-((5-(aminoiminomethyl)-2-thienyl)methyl)-. The TPSA of 148.61 Ų indicates high polarity, suggesting L-Prolinamide, N-(carboxymethyl)-beta-phenyl-D-phenylalanyl-N-((5-(aminoiminomethyl)-2-thienyl)methyl)- may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, L-Prolinamide, N-(carboxymethyl)-beta-phenyl-D-phenylalanyl-N-((5-(aminoiminomethyl)-2-thienyl)methyl)- has 5 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of L-Prolinamide, N-(carboxymethyl)-beta-phenyl-D-phenylalanyl-N-((5-(aminoiminomethyl)-2-thienyl)methyl)-?
The CAS number of L-Prolinamide, N-(carboxymethyl)-beta-phenyl-D-phenylalanyl-N-((5-(aminoiminomethyl)-2-thienyl)methyl)- is 280780-95-2.
What is the molecular formula of L-Prolinamide, N-(carboxymethyl)-beta-phenyl-D-phenylalanyl-N-((5-(aminoiminomethyl)-2-thienyl)methyl)-?
The molecular formula of L-Prolinamide, N-(carboxymethyl)-beta-phenyl-D-phenylalanyl-N-((5-(aminoiminomethyl)-2-thienyl)methyl)- is C28H31N5O4S.
What is the molecular weight of L-Prolinamide, N-(carboxymethyl)-beta-phenyl-D-phenylalanyl-N-((5-(aminoiminomethyl)-2-thienyl)methyl)-?
The molecular weight of L-Prolinamide, N-(carboxymethyl)-beta-phenyl-D-phenylalanyl-N-((5-(aminoiminomethyl)-2-thienyl)methyl)- is 533.21 g/mol.
Where can I buy L-Prolinamide, N-(carboxymethyl)-beta-phenyl-D-phenylalanyl-N-((5-(aminoiminomethyl)-2-thienyl)methyl)-?
You can request a quote for L-Prolinamide, N-(carboxymethyl)-beta-phenyl-D-phenylalanyl-N-((5-(aminoiminomethyl)-2-thienyl)methyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for L-Prolinamide, N-(carboxymethyl)-beta-phenyl-D-phenylalanyl-N-((5-(aminoiminomethyl)-2-thienyl)methyl)-?
Yes, KEHONG BIO provides custom synthesis services for L-Prolinamide, N-(carboxymethyl)-beta-phenyl-D-phenylalanyl-N-((5-(aminoiminomethyl)-2-thienyl)methyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.