N-[(Benzyloxy)carbonyl]-1-(tert-butoxycarbonyl)histidine
TL;DR: N-[(Benzyloxy)carbonyl]-1-(tert-butoxycarbonyl)histidine (CAS 32675-94-8) is a chemical compound with molecular formula C19H23N3O6 and molecular weight 389.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[1-[(2-methylpropan-2-yl)oxycarbonyl]imidazol-4-yl]-2-(phenylmethoxycarbonylamino)propanoic acid
Also Known As: N-[(Benzyloxy)carbonyl]-1-(tert-butoxycarbonyl)histidine, 3-[1-[(2-methylpropan-2-yl)oxycarbonyl]imidazol-4-yl]-2-(phenylmethoxycarbonylamino)propanoic acid, 2-Phenylmethoxycarbonylamino-3-(1-tert-butoxycarbonylimidazol-4-yl)propanoic acid
| Molecular Formula | C19H23N3O6 |
|---|---|
| Molecular Weight | 389.16 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 120.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 389.1587 |
| Heavy Atoms | 28 |
| Complexity | 556.0 |
Chemical Identifiers
| CAS Number | 32675-94-8 |
|---|---|
| SMILES | CC(C)(C)OC(=O)N1C=C(N=C1)CC(C(=O)O)NC(=O)OCC2=CC=CC=C2 |
| InChIKey | QASQSKCFDDEAKG-UHFFFAOYSA-N |
Product Overview
N-[(Benzyloxy)carbonyl]-1-(tert-butoxycarbonyl)histidine (CAS 32675-94-8), with molecular formula C19H23N3O6 and molecular weight 389.16 g/mol. IUPAC: 3-[1-[(2-methylpropan-2-yl)oxycarbonyl]imidazol-4-yl]-2-(phenylmethoxycarbonylamino)propanoic acid.
Chemical Property Profile of N-[(Benzyloxy)carbonyl]-1-(tert-butoxycarbonyl)histidine
Property Insights of N-[(Benzyloxy)carbonyl]-1-(tert-butoxycarbonyl)histidine
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[(Benzyloxy)carbonyl]-1-(tert-butoxycarbonyl)histidine. The TPSA of 120.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[(Benzyloxy)carbonyl]-1-(tert-butoxycarbonyl)histidine. Following Lipinski's Rule of Five, N-[(Benzyloxy)carbonyl]-1-(tert-butoxycarbonyl)histidine has 2 hydrogen bond donor(s) and 7 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-[(Benzyloxy)carbonyl]-1-(tert-butoxycarbonyl)histidine?
The CAS number of N-[(Benzyloxy)carbonyl]-1-(tert-butoxycarbonyl)histidine is 32675-94-8.
What is the molecular formula of N-[(Benzyloxy)carbonyl]-1-(tert-butoxycarbonyl)histidine?
The molecular formula of N-[(Benzyloxy)carbonyl]-1-(tert-butoxycarbonyl)histidine is C19H23N3O6.
What is the molecular weight of N-[(Benzyloxy)carbonyl]-1-(tert-butoxycarbonyl)histidine?
The molecular weight of N-[(Benzyloxy)carbonyl]-1-(tert-butoxycarbonyl)histidine is 389.16 g/mol.
Where can I buy N-[(Benzyloxy)carbonyl]-1-(tert-butoxycarbonyl)histidine?
You can request a quote for N-[(Benzyloxy)carbonyl]-1-(tert-butoxycarbonyl)histidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(Benzyloxy)carbonyl]-1-(tert-butoxycarbonyl)histidine?
Yes, KEHONG BIO provides custom synthesis services for N-[(Benzyloxy)carbonyl]-1-(tert-butoxycarbonyl)histidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.