SQ 30774
TL;DR: SQ 30774 (CAS 121995-36-6) is a chemical compound with molecular formula C32H45N7O5 and molecular weight 607.35 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tert-butyl N-[(2S)-1-[[(2S)-2-[[(1R,2S)-3-cyclohexyl-1-hydroxy-1-(1H-imidazol-2-yl)propan-2-yl]amino]-3-(1H-imidazol-5-yl)propanoyl]amino]-1-oxo-3-phenylpropan-2-yl]carbamate
Also Known As: tert-butyl N-[(2S)-1-[[(2S)-2-[[(1R,2S)-3-cyclohexyl-1-hydroxy-1-(1H-imidazol-2-yl)propan-2-yl]amino]-3-(1H-imidazol-5-yl)propanoyl]amino]-1-oxo-3-phenylpropan-2-yl]carbamate, Boc-phe-N-(-1-(cyclohexylmethyl)-2-hydroxy-2-(1H-imidazol-2-yl)ethyl)histidinamide, ((1,1-Dimethylethoxy)carbonyl)-L-phenylalanyl-N(1-(cyclohexylmethyl)-2-hydroxy-2-(1H-imidazol-2-yl)ethyl)-L-histidinamide, L-Histidinamide, N-((1,1-dimethylethoxy)carbonyl)-L-phenylalanyl-nalpha-(1-(cyclohexylmethyl)-2-hydroxy-2-(1H-imidazol-2-yl)ethyl)-, (R-(R*,S*))-, N-{(2S)-2-[(tert-Butoxycarbonyl)amino]-3-phenylpropanoyl}-Nalpha-[(1R,2S)-3-cyclohexyl-1-hydroxy-1-(1H-imidazol-2-yl)propan-2-yl]-L-histidinamide
| Molecular Formula | C32H45N7O5 |
|---|---|
| Molecular Weight | 607.35 g/mol |
| LogP | 3.4849 |
| Topological Polar Surface Area | 174.12 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 13 |
| Exact Mass | 607.3482 |
| Heavy Atoms | 44 |
| Complexity | 1302.4772 |
Chemical Identifiers
| CAS Number | 121995-36-6 |
|---|---|
| SMILES | CC(C)(C)OC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NC(=O)[C@H](CC2=CN=CN2)N[C@@H](CC3CCCCC3)[C@H](C4=NC=CN4)O |
Product Overview
SQ 30774 (CAS 121995-36-6), with molecular formula C32H45N7O5 and molecular weight 607.35 g/mol. IUPAC: tert-butyl N-[(2S)-1-[[(2S)-2-[[(1R,2S)-3-cyclohexyl-1-hydroxy-1-(1H-imidazol-2-yl)propan-2-yl]amino]-3-(1H-imidazol-5-yl)propanoyl]amino]-1-oxo-3-phenylpropan-2-yl]carbamate.
Chemical Property Profile of SQ 30774
Property Insights of SQ 30774
The XLogP value of 3.4849 indicates that SQ 30774 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 174.12 Ų indicates high polarity, suggesting SQ 30774 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, SQ 30774 has 6 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 SQ 30774?
The CAS number of SQ 30774 is 121995-36-6.
What is the molecular formula of SQ 30774?
The molecular formula of SQ 30774 is C32H45N7O5.
What is the molecular weight of SQ 30774?
The molecular weight of SQ 30774 is 607.35 g/mol.
Where can I buy SQ 30774?
You can request a quote for SQ 30774 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for SQ 30774?
Yes, KEHONG BIO provides custom synthesis services for SQ 30774 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.