N-prop-2-enyl-2,3-dihydro-1,4-benzodioxine-6-carboxamide
TL;DR: N-prop-2-enyl-2,3-dihydro-1,4-benzodioxine-6-carboxamide (CAS 838898-33-2) is a chemical compound with molecular formula C12H13NO3 and molecular weight 219.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-prop-2-enyl-2,3-dihydro-1,4-benzodioxine-6-carboxamide
Also Known As: N-prop-2-enyl-2,3-dihydro-1,4-benzodioxine-6-carboxamide, N-allyl-2,3-dihydrobenzo[b][1,4]dioxine-6-carboxamide, 2H,3H-benzo[3,4-e]1,4-dioxin-6-yl-N-prop-2-enylcarboxamide, N-(prop-2-en-1-yl)-2,3-dihydro-1,4-benzodioxine-6-carboxamide
| Molecular Formula | C12H13NO3 |
|---|---|
| Molecular Weight | 219.09 g/mol |
| LogP | 1.3736 |
| Topological Polar Surface Area | 47.56 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 219.08954 |
| Heavy Atoms | 16 |
| Complexity | 414.72495 |
Chemical Identifiers
| CAS Number | 838898-33-2 |
|---|---|
| SMILES | C=CCNC(=O)C1=CC2=C(C=C1)OCCO2 |
Product Overview
N-prop-2-enyl-2,3-dihydro-1,4-benzodioxine-6-carboxamide (CAS 838898-33-2), with molecular formula C12H13NO3 and molecular weight 219.09 g/mol. IUPAC: N-prop-2-enyl-2,3-dihydro-1,4-benzodioxine-6-carboxamide.
Chemical Property Profile of N-prop-2-enyl-2,3-dihydro-1,4-benzodioxine-6-carboxamide
Property Insights of N-prop-2-enyl-2,3-dihydro-1,4-benzodioxine-6-carboxamide
The XLogP value of 1.3736 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-prop-2-enyl-2,3-dihydro-1,4-benzodioxine-6-carboxamide. With a topological polar surface area (TPSA) of 47.56 Ų, N-prop-2-enyl-2,3-dihydro-1,4-benzodioxine-6-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-prop-2-enyl-2,3-dihydro-1,4-benzodioxine-6-carboxamide 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 N-prop-2-enyl-2,3-dihydro-1,4-benzodioxine-6-carboxamide?
The CAS number of N-prop-2-enyl-2,3-dihydro-1,4-benzodioxine-6-carboxamide is 838898-33-2.
What is the molecular formula of N-prop-2-enyl-2,3-dihydro-1,4-benzodioxine-6-carboxamide?
The molecular formula of N-prop-2-enyl-2,3-dihydro-1,4-benzodioxine-6-carboxamide is C12H13NO3.
What is the molecular weight of N-prop-2-enyl-2,3-dihydro-1,4-benzodioxine-6-carboxamide?
The molecular weight of N-prop-2-enyl-2,3-dihydro-1,4-benzodioxine-6-carboxamide is 219.09 g/mol.
Where can I buy N-prop-2-enyl-2,3-dihydro-1,4-benzodioxine-6-carboxamide?
You can request a quote for N-prop-2-enyl-2,3-dihydro-1,4-benzodioxine-6-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-prop-2-enyl-2,3-dihydro-1,4-benzodioxine-6-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-prop-2-enyl-2,3-dihydro-1,4-benzodioxine-6-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.