benzyl 1-(1H-indol-3-ylmethyl)-2-(2-naphthylamino)-2-oxoethylcarbamate
TL;DR: benzyl 1-(1H-indol-3-ylmethyl)-2-(2-naphthylamino)-2-oxoethylcarbamate (CAS 96372-77-9) is a chemical compound with molecular formula C29H25N3O3 and molecular weight 463.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl N-[3-(1H-indol-3-yl)-1-(naphthalen-2-ylamino)-1-oxopropan-2-yl]carbamate
Also Known As: carbobenzyloxytryptophan beta-naphthylamide, benzyl 1-(1H-indol-3-ylmethyl)-2-(2-naphthylamino)-2-oxoethylcarbamate, Benzyl N-[2-(1H-indol-3-yl)-1-(naphthalen-2-ylcarbamoyl)ethyl]carbamate, (S)-Benzyl (3-(1H-indol-3-yl)-1-(naphthalen-2-ylamino)-1-oxopropan-2-yl)carbamate, benzyl N-[(1S)-2-(1H-indol-3-yl)-1-[(naphthalen-2-yl)carbamoyl]ethyl]carbamate
| Molecular Formula | C29H25N3O3 |
|---|---|
| Molecular Weight | 463.19 g/mol |
| LogP | 5.7973 |
| Topological Polar Surface Area | 83.22 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 463.1896 |
| Heavy Atoms | 35 |
| Complexity | 1476.6388 |
Chemical Identifiers
| CAS Number | 96372-77-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)COC(=O)NC(CC2=CNC3=CC=CC=C32)C(=O)NC4=CC5=CC=CC=C5C=C4 |
Product Overview
benzyl 1-(1H-indol-3-ylmethyl)-2-(2-naphthylamino)-2-oxoethylcarbamate (CAS 96372-77-9), with molecular formula C29H25N3O3 and molecular weight 463.19 g/mol. IUPAC: benzyl N-[3-(1H-indol-3-yl)-1-(naphthalen-2-ylamino)-1-oxopropan-2-yl]carbamate.
Chemical Property Profile of benzyl 1-(1H-indol-3-ylmethyl)-2-(2-naphthylamino)-2-oxoethylcarbamate
Property Insights of benzyl 1-(1H-indol-3-ylmethyl)-2-(2-naphthylamino)-2-oxoethylcarbamate
The XLogP value of 5.7973 indicates that benzyl 1-(1H-indol-3-ylmethyl)-2-(2-naphthylamino)-2-oxoethylcarbamate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.22 Ų falls within the moderate polarity range, balancing permeability and solubility for benzyl 1-(1H-indol-3-ylmethyl)-2-(2-naphthylamino)-2-oxoethylcarbamate. Following Lipinski's Rule of Five, benzyl 1-(1H-indol-3-ylmethyl)-2-(2-naphthylamino)-2-oxoethylcarbamate has 3 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of benzyl 1-(1H-indol-3-ylmethyl)-2-(2-naphthylamino)-2-oxoethylcarbamate?
The CAS number of benzyl 1-(1H-indol-3-ylmethyl)-2-(2-naphthylamino)-2-oxoethylcarbamate is 96372-77-9.
What is the molecular formula of benzyl 1-(1H-indol-3-ylmethyl)-2-(2-naphthylamino)-2-oxoethylcarbamate?
The molecular formula of benzyl 1-(1H-indol-3-ylmethyl)-2-(2-naphthylamino)-2-oxoethylcarbamate is C29H25N3O3.
What is the molecular weight of benzyl 1-(1H-indol-3-ylmethyl)-2-(2-naphthylamino)-2-oxoethylcarbamate?
The molecular weight of benzyl 1-(1H-indol-3-ylmethyl)-2-(2-naphthylamino)-2-oxoethylcarbamate is 463.19 g/mol.
Where can I buy benzyl 1-(1H-indol-3-ylmethyl)-2-(2-naphthylamino)-2-oxoethylcarbamate?
You can request a quote for benzyl 1-(1H-indol-3-ylmethyl)-2-(2-naphthylamino)-2-oxoethylcarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for benzyl 1-(1H-indol-3-ylmethyl)-2-(2-naphthylamino)-2-oxoethylcarbamate?
Yes, KEHONG BIO provides custom synthesis services for benzyl 1-(1H-indol-3-ylmethyl)-2-(2-naphthylamino)-2-oxoethylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.