(propan-2-ylideneamino) N-(3-methylphenyl)carbamate
TL;DR: (propan-2-ylideneamino) N-(3-methylphenyl)carbamate (CAS 18779-88-9) is a chemical compound with molecular formula C11H14N2O2 and molecular weight 206.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(propan-2-ylideneamino) N-(3-methylphenyl)carbamate
Also Known As: NCIOpen2_004136, KST-1A2268, (propan-2-ylideneamino) N-(3-methylphenyl)carbamate, O-(N-(m-tolyl)carbamoyl)acetone oxime, Acetone,O-(m-tolylcarbamoyl)oxime (8CI)
| Molecular Formula | C11H14N2O2 |
|---|---|
| Molecular Weight | 206.11 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 50.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 206.10553 |
| Heavy Atoms | 15 |
| Complexity | 247.0 |
Chemical Identifiers
| CAS Number | 18779-88-9 |
|---|---|
| SMILES | CC1=CC(=CC=C1)NC(=O)ON=C(C)C |
| InChIKey | MNKVHPDQFOMZBL-UHFFFAOYSA-N |
Product Overview
(propan-2-ylideneamino) N-(3-methylphenyl)carbamate (CAS 18779-88-9), with molecular formula C11H14N2O2 and molecular weight 206.11 g/mol. IUPAC: (propan-2-ylideneamino) N-(3-methylphenyl)carbamate.
Chemical Property Profile of (propan-2-ylideneamino) N-(3-methylphenyl)carbamate
Property Insights of (propan-2-ylideneamino) N-(3-methylphenyl)carbamate
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (propan-2-ylideneamino) N-(3-methylphenyl)carbamate. With a topological polar surface area (TPSA) of 50.7 Ų, (propan-2-ylideneamino) N-(3-methylphenyl)carbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (propan-2-ylideneamino) N-(3-methylphenyl)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 (propan-2-ylideneamino) N-(3-methylphenyl)carbamate?
The CAS number of (propan-2-ylideneamino) N-(3-methylphenyl)carbamate is 18779-88-9.
What is the molecular formula of (propan-2-ylideneamino) N-(3-methylphenyl)carbamate?
The molecular formula of (propan-2-ylideneamino) N-(3-methylphenyl)carbamate is C11H14N2O2.
What is the molecular weight of (propan-2-ylideneamino) N-(3-methylphenyl)carbamate?
The molecular weight of (propan-2-ylideneamino) N-(3-methylphenyl)carbamate is 206.11 g/mol.
Where can I buy (propan-2-ylideneamino) N-(3-methylphenyl)carbamate?
You can request a quote for (propan-2-ylideneamino) N-(3-methylphenyl)carbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (propan-2-ylideneamino) N-(3-methylphenyl)carbamate?
Yes, KEHONG BIO provides custom synthesis services for (propan-2-ylideneamino) N-(3-methylphenyl)carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.