1,3-Propanediol, 2-methyl-2-propyl-, N-methyl-N-(1-phenyl-2-propyl)carbamate
TL;DR: 1,3-Propanediol, 2-methyl-2-propyl-, N-methyl-N-(1-phenyl-2-propyl)carbamate (CAS 25384-40-1) is a chemical compound with molecular formula C18H29NO3 and molecular weight 307.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(hydroxymethyl)-2-methylpentyl] N-methyl-N-(1-phenylpropan-2-yl)carbamate
Also Known As: 2-(hydroxymethyl)-2-methylpentyl methyl(1-phenylpropan-2-yl)carbamate, 1,3-Propanediol, 2-methyl-2-propyl-, N-methyl-N-(1-phenyl-2-propyl)carbamate, 2-Methyl-2-propyl-1,3-propanediol N-methyl-N-(1-phenyl-2-propyl)carbamate, [2-(hydroxymethyl)-2-methylpentyl] N-methyl-N-(1-phenylpropan-2-yl)carbamate, 2-(Hydroxymethyl)-2-methylpentyl=N-methyl-N-(alpha-methylphenethyl)carbamate
| Molecular Formula | C18H29NO3 |
|---|---|
| Molecular Weight | 307.21 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 49.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 9 |
| Exact Mass | 307.21475 |
| Heavy Atoms | 22 |
| Complexity | 328.0 |
Chemical Identifiers
| CAS Number | 25384-40-1 |
|---|---|
| SMILES | CCCC(C)(CO)COC(=O)N(C)C(C)CC1=CC=CC=C1 |
| InChIKey | KRSJNPQCDCZRDP-UHFFFAOYSA-N |
Product Overview
1,3-Propanediol, 2-methyl-2-propyl-, N-methyl-N-(1-phenyl-2-propyl)carbamate (CAS 25384-40-1), with molecular formula C18H29NO3 and molecular weight 307.21 g/mol. IUPAC: [2-(hydroxymethyl)-2-methylpentyl] N-methyl-N-(1-phenylpropan-2-yl)carbamate.
Chemical Property Profile of 1,3-Propanediol, 2-methyl-2-propyl-, N-methyl-N-(1-phenyl-2-propyl)carbamate
Property Insights of 1,3-Propanediol, 2-methyl-2-propyl-, N-methyl-N-(1-phenyl-2-propyl)carbamate
The XLogP value of 3.9 indicates that 1,3-Propanediol, 2-methyl-2-propyl-, N-methyl-N-(1-phenyl-2-propyl)carbamate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.8 Ų, 1,3-Propanediol, 2-methyl-2-propyl-, N-methyl-N-(1-phenyl-2-propyl)carbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Propanediol, 2-methyl-2-propyl-, N-methyl-N-(1-phenyl-2-propyl)carbamate has 1 hydrogen bond donor(s) and 3 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 1,3-Propanediol, 2-methyl-2-propyl-, N-methyl-N-(1-phenyl-2-propyl)carbamate?
The CAS number of 1,3-Propanediol, 2-methyl-2-propyl-, N-methyl-N-(1-phenyl-2-propyl)carbamate is 25384-40-1.
What is the molecular formula of 1,3-Propanediol, 2-methyl-2-propyl-, N-methyl-N-(1-phenyl-2-propyl)carbamate?
The molecular formula of 1,3-Propanediol, 2-methyl-2-propyl-, N-methyl-N-(1-phenyl-2-propyl)carbamate is C18H29NO3.
What is the molecular weight of 1,3-Propanediol, 2-methyl-2-propyl-, N-methyl-N-(1-phenyl-2-propyl)carbamate?
The molecular weight of 1,3-Propanediol, 2-methyl-2-propyl-, N-methyl-N-(1-phenyl-2-propyl)carbamate is 307.21 g/mol.
Where can I buy 1,3-Propanediol, 2-methyl-2-propyl-, N-methyl-N-(1-phenyl-2-propyl)carbamate?
You can request a quote for 1,3-Propanediol, 2-methyl-2-propyl-, N-methyl-N-(1-phenyl-2-propyl)carbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Propanediol, 2-methyl-2-propyl-, N-methyl-N-(1-phenyl-2-propyl)carbamate?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Propanediol, 2-methyl-2-propyl-, N-methyl-N-(1-phenyl-2-propyl)carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.