D-Phenylalanine, N-((3-(((2-hydroxy-1-methyl-2-phenylethyl)methylamino)carbonyl)-2-methyl-6-quinoxalinyl)carbonyl)-, N,N'-dioxide, (R-(R*,S*))-
TL;DR: D-Phenylalanine, N-((3-(((2-hydroxy-1-methyl-2-phenylethyl)methylamino)carbonyl)-2-methyl-6-quinoxalinyl)carbonyl)-, N,N'-dioxide, (R-(R*,S*))- (CAS 81485-16-7) is a chemical compound with molecular formula C30H30N4O7-2 and molecular weight 558.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R)-2-[[3-[[(1R,2S)-1-hydroxy-1-phenylpropan-2-yl]-methylcarbamoyl]-2-methyl-1,4-dioxidoquinoxaline-6-carbonyl]amino]-3-phenylpropanoic acid
Also Known As: D-Phenylalanine, N-((3-(((2-hydroxy-1-methyl-2-phenylethyl)methylamino)carbonyl)-2-methyl-6-quinoxalinyl)carbonyl)-, N,N'-dioxide, (R-(R*,S*))-, (2R)-2-[[3-[[(1R,2S)-1-hydroxy-1-phenylpropan-2-yl]-methylcarbamoyl]-2-methyl-1,4-dioxidoquinoxaline-6-carbonyl]amino]-3-phenylpropanoic acid, 6-{[(1R)-1-CARBOXY-2-PHENYLETHYL]CARBAMOYL}-3-{[(1R,2S)-1-HYDROXY-1-PHENYLPROPAN-2-YL](METHYL)CARBAMOYL}-2-METHYLQUINOXALINE-1,4-BIS(OLATE)
| Molecular Formula | C30H30N4O7-2 |
|---|---|
| Molecular Weight | 558.21 g/mol |
| LogP | 3.5463 |
| Topological Polar Surface Area | 159.54 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 9 |
| Exact Mass | 558.2114 |
| Heavy Atoms | 41 |
| Complexity | 1462.1763 |
Chemical Identifiers
| CAS Number | 81485-16-7 |
|---|---|
| SMILES | CC1=C(N(C2=C(N1[O-])C=CC(=C2)C(=O)N[C@H](CC3=CC=CC=C3)C(=O)O)[O-])C(=O)N(C)[C@@H](C)[C@@H](C4=CC=CC=C4)O |
Product Overview
D-Phenylalanine, N-((3-(((2-hydroxy-1-methyl-2-phenylethyl)methylamino)carbonyl)-2-methyl-6-quinoxalinyl)carbonyl)-, N,N'-dioxide, (R-(R*,S*))- (CAS 81485-16-7), with molecular formula C30H30N4O7-2 and molecular weight 558.21 g/mol. IUPAC: (2R)-2-[[3-[[(1R,2S)-1-hydroxy-1-phenylpropan-2-yl]-methylcarbamoyl]-2-methyl-1,4-dioxidoquinoxaline-6-carbonyl]amino]-3-phenylpropanoic acid.
Chemical Property Profile of D-Phenylalanine, N-((3-(((2-hydroxy-1-methyl-2-phenylethyl)methylamino)carbonyl)-2-methyl-6-quinoxalinyl)carbonyl)-, N,N'-dioxide, (R-(R*,S*))-
Property Insights of D-Phenylalanine, N-((3-(((2-hydroxy-1-methyl-2-phenylethyl)methylamino)carbonyl)-2-methyl-6-quinoxalinyl)carbonyl)-, N,N'-dioxide, (R-(R*,S*))-
The XLogP value of 3.5463 indicates that D-Phenylalanine, N-((3-(((2-hydroxy-1-methyl-2-phenylethyl)methylamino)carbonyl)-2-methyl-6-quinoxalinyl)carbonyl)-, N,N'-dioxide, (R-(R*,S*))- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 159.54 Ų indicates high polarity, suggesting D-Phenylalanine, N-((3-(((2-hydroxy-1-methyl-2-phenylethyl)methylamino)carbonyl)-2-methyl-6-quinoxalinyl)carbonyl)-, N,N'-dioxide, (R-(R*,S*))- may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, D-Phenylalanine, N-((3-(((2-hydroxy-1-methyl-2-phenylethyl)methylamino)carbonyl)-2-methyl-6-quinoxalinyl)carbonyl)-, N,N'-dioxide, (R-(R*,S*))- has 3 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of D-Phenylalanine, N-((3-(((2-hydroxy-1-methyl-2-phenylethyl)methylamino)carbonyl)-2-methyl-6-quinoxalinyl)carbonyl)-, N,N'-dioxide, (R-(R*,S*))-?
The CAS number of D-Phenylalanine, N-((3-(((2-hydroxy-1-methyl-2-phenylethyl)methylamino)carbonyl)-2-methyl-6-quinoxalinyl)carbonyl)-, N,N'-dioxide, (R-(R*,S*))- is 81485-16-7.
What is the molecular formula of D-Phenylalanine, N-((3-(((2-hydroxy-1-methyl-2-phenylethyl)methylamino)carbonyl)-2-methyl-6-quinoxalinyl)carbonyl)-, N,N'-dioxide, (R-(R*,S*))-?
The molecular formula of D-Phenylalanine, N-((3-(((2-hydroxy-1-methyl-2-phenylethyl)methylamino)carbonyl)-2-methyl-6-quinoxalinyl)carbonyl)-, N,N'-dioxide, (R-(R*,S*))- is C30H30N4O7-2.
What is the molecular weight of D-Phenylalanine, N-((3-(((2-hydroxy-1-methyl-2-phenylethyl)methylamino)carbonyl)-2-methyl-6-quinoxalinyl)carbonyl)-, N,N'-dioxide, (R-(R*,S*))-?
The molecular weight of D-Phenylalanine, N-((3-(((2-hydroxy-1-methyl-2-phenylethyl)methylamino)carbonyl)-2-methyl-6-quinoxalinyl)carbonyl)-, N,N'-dioxide, (R-(R*,S*))- is 558.21 g/mol.
Where can I buy D-Phenylalanine, N-((3-(((2-hydroxy-1-methyl-2-phenylethyl)methylamino)carbonyl)-2-methyl-6-quinoxalinyl)carbonyl)-, N,N'-dioxide, (R-(R*,S*))-?
You can request a quote for D-Phenylalanine, N-((3-(((2-hydroxy-1-methyl-2-phenylethyl)methylamino)carbonyl)-2-methyl-6-quinoxalinyl)carbonyl)-, N,N'-dioxide, (R-(R*,S*))- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for D-Phenylalanine, N-((3-(((2-hydroxy-1-methyl-2-phenylethyl)methylamino)carbonyl)-2-methyl-6-quinoxalinyl)carbonyl)-, N,N'-dioxide, (R-(R*,S*))-?
Yes, KEHONG BIO provides custom synthesis services for D-Phenylalanine, N-((3-(((2-hydroxy-1-methyl-2-phenylethyl)methylamino)carbonyl)-2-methyl-6-quinoxalinyl)carbonyl)-, N,N'-dioxide, (R-(R*,S*))- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.