![tert-butyl N-[1-[(1-hydrazinyl-4-methylsulfanyl-1-oxobutan-2-yl)amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]carbamate structure](/static/products/5262/5262-01-1.webp)
tert-butyl N-[1-[(1-hydrazinyl-4-methylsulfanyl-1-oxobutan-2-yl)amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]carbamate
TL;DR: tert-butyl N-[1-[(1-hydrazinyl-4-methylsulfanyl-1-oxobutan-2-yl)amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]carbamate (CAS 5262-01-1) is a chemical compound with molecular formula C21H31N5O4S and molecular weight 449.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tert-butyl N-[1-[(1-hydrazinyl-4-methylsulfanyl-1-oxobutan-2-yl)amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]carbamate
Also Known As: tert-butyl N-[1-[(1-hydrazinyl-4-methylsulfanyl-1-oxobutan-2-yl)amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]carbamate, [1-(1-Hydrazinocarbonyl-3-methylsulfanyl-propylcarbamoyl)-2-(1H-indol-3-yl)-ethyl]-carbamic acid tert-butyl ester, tert-Butyl [1-{[1-hydrazinyl-4-(methylsulfanyl)-1-oxobutan-2-yl]amino}-3-(1H-indol-3-yl)-1-oxopropan-2-yl]carbamate, tert-butyl N-[2-[[1-(hydrazinecarbonyl)-3-methylsulfanyl-propyl]amino]-1-(1H-indol-3-ylmethyl)-2-oxo-ethyl]carbamate
| Molecular Formula | C21H31N5O4S |
|---|---|
| Molecular Weight | 449.21 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 164.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 11 |
| Exact Mass | 449.2097 |
| Heavy Atoms | 31 |
| Complexity | 627.0 |
Chemical Identifiers
| CAS Number | 5262-01-1 |
|---|---|
| SMILES | CC(C)(C)OC(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)NC(CCSC)C(=O)NN |
| InChIKey | KJUJYAAERUTXTH-UHFFFAOYSA-N |
Product Overview
tert-butyl N-[1-[(1-hydrazinyl-4-methylsulfanyl-1-oxobutan-2-yl)amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]carbamate (CAS 5262-01-1), with molecular formula C21H31N5O4S and molecular weight 449.21 g/mol. IUPAC: tert-butyl N-[1-[(1-hydrazinyl-4-methylsulfanyl-1-oxobutan-2-yl)amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]carbamate.
Chemical Property Profile of tert-butyl N-[1-[(1-hydrazinyl-4-methylsulfanyl-1-oxobutan-2-yl)amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]carbamate
Property Insights of tert-butyl N-[1-[(1-hydrazinyl-4-methylsulfanyl-1-oxobutan-2-yl)amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]carbamate
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for tert-butyl N-[1-[(1-hydrazinyl-4-methylsulfanyl-1-oxobutan-2-yl)amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]carbamate. The TPSA of 164.0 Ų indicates high polarity, suggesting tert-butyl N-[1-[(1-hydrazinyl-4-methylsulfanyl-1-oxobutan-2-yl)amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]carbamate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, tert-butyl N-[1-[(1-hydrazinyl-4-methylsulfanyl-1-oxobutan-2-yl)amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]carbamate has 5 hydrogen bond donor(s) and 6 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 tert-butyl N-[1-[(1-hydrazinyl-4-methylsulfanyl-1-oxobutan-2-yl)amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]carbamate?
The CAS number of tert-butyl N-[1-[(1-hydrazinyl-4-methylsulfanyl-1-oxobutan-2-yl)amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]carbamate is 5262-01-1.
What is the molecular formula of tert-butyl N-[1-[(1-hydrazinyl-4-methylsulfanyl-1-oxobutan-2-yl)amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]carbamate?
The molecular formula of tert-butyl N-[1-[(1-hydrazinyl-4-methylsulfanyl-1-oxobutan-2-yl)amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]carbamate is C21H31N5O4S.
What is the molecular weight of tert-butyl N-[1-[(1-hydrazinyl-4-methylsulfanyl-1-oxobutan-2-yl)amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]carbamate?
The molecular weight of tert-butyl N-[1-[(1-hydrazinyl-4-methylsulfanyl-1-oxobutan-2-yl)amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]carbamate is 449.21 g/mol.
Where can I buy tert-butyl N-[1-[(1-hydrazinyl-4-methylsulfanyl-1-oxobutan-2-yl)amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]carbamate?
You can request a quote for tert-butyl N-[1-[(1-hydrazinyl-4-methylsulfanyl-1-oxobutan-2-yl)amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]carbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for tert-butyl N-[1-[(1-hydrazinyl-4-methylsulfanyl-1-oxobutan-2-yl)amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]carbamate?
Yes, KEHONG BIO provides custom synthesis services for tert-butyl N-[1-[(1-hydrazinyl-4-methylsulfanyl-1-oxobutan-2-yl)amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.