GNRH (1-9)nonapeptide ethylamide, penicillamine-(tert-butyl)(6)-
TL;DR: GNRH (1-9)nonapeptide ethylamide, penicillamine-(tert-butyl)(6)- (CAS 61012-20-2) is a chemical compound with molecular formula C62H90N16O12S and molecular weight 1282.66 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-N-[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-3-tert-butylsulfanyl-1-[[(2S)-1-[[(2S)-5-(diaminomethylideneamino)-1-[(2S)-2-(ethylcarbamoyl)pyrrolidin-1-yl]-1-oxopentan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]amino]-3-hydroxy-1-oxopropan-2-yl]amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]amino]-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl]-5-oxopyrrolidine-2-carboxamide
Also Known As: PCA(tBu)-EA-GnRH, EINECS 262-558-3, GNRH (1-9)nonapeptide ethylamide, penicillamine-(tert-butyl)(6)-, D-penicillamine-(t-butyl)(6)-GnRH(1-9)nonapeptide ethylamide, Luteinizing hormone-releasing factor (pig), 6-(3-((1,1-dimethylethyl)thio)-d-valine)-9-(N-ethyl-l-prolinamide)-10-deglycinamide-
| Molecular Formula | C62H90N16O12S |
|---|---|
| Molecular Weight | 1282.66 g/mol |
| LogP | -0.1739 |
| Topological Polar Surface Area | 431.54 Ų |
| Hydrogen Bond Donors | 15 |
| Hydrogen Bond Acceptors | 15 |
| Rotatable Bonds | 32 |
| Exact Mass | 1282.6644 |
| Heavy Atoms | 91 |
| Complexity | 3216.7307 |
Chemical Identifiers
| CAS Number | 61012-20-2 |
|---|---|
| SMILES | CCNC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](C(C)(C)SC(C)(C)C)NC(=O)[C@H](CC2=CC=C(C=C2)O)NC(=O)[C@H](CO)NC(=O)[C@H](CC3=CNC4=CC=CC=C43)NC(=O)[C@H](CC5=CN=CN5)NC(=O)[C@@H]6CCC(=O)N6 |
Product Overview
GNRH (1-9)nonapeptide ethylamide, penicillamine-(tert-butyl)(6)- (CAS 61012-20-2), with molecular formula C62H90N16O12S and molecular weight 1282.66 g/mol. IUPAC: (2S)-N-[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-3-tert-butylsulfanyl-1-[[(2S)-1-[[(2S)-5-(diaminomethylideneamino)-1-[(2S)-2-(ethylcarbamoyl)pyrrolidin-1-yl]-1-oxopentan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]amino]-3-hydroxy-1-oxopropan-2-yl]amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]amino]-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl]-5-oxopyrrolidine-2-carboxamide.
Chemical Property Profile of GNRH (1-9)nonapeptide ethylamide, penicillamine-(tert-butyl)(6)-
Property Insights of GNRH (1-9)nonapeptide ethylamide, penicillamine-(tert-butyl)(6)-
The XLogP value of -0.1739 indicates that GNRH (1-9)nonapeptide ethylamide, penicillamine-(tert-butyl)(6)- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 431.54 Ų indicates high polarity, suggesting GNRH (1-9)nonapeptide ethylamide, penicillamine-(tert-butyl)(6)- may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, GNRH (1-9)nonapeptide ethylamide, penicillamine-(tert-butyl)(6)- has 15 hydrogen bond donor(s) and 15 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of GNRH (1-9)nonapeptide ethylamide, penicillamine-(tert-butyl)(6)-?
The CAS number of GNRH (1-9)nonapeptide ethylamide, penicillamine-(tert-butyl)(6)- is 61012-20-2.
What is the molecular formula of GNRH (1-9)nonapeptide ethylamide, penicillamine-(tert-butyl)(6)-?
The molecular formula of GNRH (1-9)nonapeptide ethylamide, penicillamine-(tert-butyl)(6)- is C62H90N16O12S.
What is the molecular weight of GNRH (1-9)nonapeptide ethylamide, penicillamine-(tert-butyl)(6)-?
The molecular weight of GNRH (1-9)nonapeptide ethylamide, penicillamine-(tert-butyl)(6)- is 1282.66 g/mol.
Where can I buy GNRH (1-9)nonapeptide ethylamide, penicillamine-(tert-butyl)(6)-?
You can request a quote for GNRH (1-9)nonapeptide ethylamide, penicillamine-(tert-butyl)(6)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for GNRH (1-9)nonapeptide ethylamide, penicillamine-(tert-butyl)(6)-?
Yes, KEHONG BIO provides custom synthesis services for GNRH (1-9)nonapeptide ethylamide, penicillamine-(tert-butyl)(6)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.