4H-1,3-Benzoxazin-4-one, 2,3-dihydro-3-propyl-
TL;DR: 4H-1,3-Benzoxazin-4-one, 2,3-dihydro-3-propyl- (CAS 20973-05-1) is a chemical compound with molecular formula C11H13NO2 and molecular weight 191.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-propyl-2H-1,3-benzoxazin-4-one
Also Known As: 3-propyl-2H-1,3-benzoxazin-4-one, 4H-1,3-BENZOXAZIN-4-ONE, 2,3-DIHYDRO-3-PROPYL-, 2,3-Dihydro-3-propyl-4H-1,3-benzoxazin-4-one, 3-Propyl-2H-1,3-benzoxazin-4(3H)-one, 3-propyl-2,3-dihydro-4H-1,3-benzoxazin-4-one
| Molecular Formula | C11H13NO2 |
|---|---|
| Molecular Weight | 191.09 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 191.09464 |
| Heavy Atoms | 14 |
| Complexity | 217.0 |
Chemical Identifiers
| CAS Number | 20973-05-1 |
|---|---|
| SMILES | CCCN1COC2=CC=CC=C2C1=O |
| InChIKey | NULIEPRMFAOWHI-UHFFFAOYSA-N |
Product Overview
4H-1,3-Benzoxazin-4-one, 2,3-dihydro-3-propyl- (CAS 20973-05-1), with molecular formula C11H13NO2 and molecular weight 191.09 g/mol. IUPAC: 3-propyl-2H-1,3-benzoxazin-4-one.
Chemical Property Profile of 4H-1,3-Benzoxazin-4-one, 2,3-dihydro-3-propyl-
Property Insights of 4H-1,3-Benzoxazin-4-one, 2,3-dihydro-3-propyl-
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4H-1,3-Benzoxazin-4-one, 2,3-dihydro-3-propyl-. With a topological polar surface area (TPSA) of 29.5 Ų, 4H-1,3-Benzoxazin-4-one, 2,3-dihydro-3-propyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4H-1,3-Benzoxazin-4-one, 2,3-dihydro-3-propyl- has 0 hydrogen bond donor(s) and 2 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 4H-1,3-Benzoxazin-4-one, 2,3-dihydro-3-propyl-?
The CAS number of 4H-1,3-Benzoxazin-4-one, 2,3-dihydro-3-propyl- is 20973-05-1.
What is the molecular formula of 4H-1,3-Benzoxazin-4-one, 2,3-dihydro-3-propyl-?
The molecular formula of 4H-1,3-Benzoxazin-4-one, 2,3-dihydro-3-propyl- is C11H13NO2.
What is the molecular weight of 4H-1,3-Benzoxazin-4-one, 2,3-dihydro-3-propyl-?
The molecular weight of 4H-1,3-Benzoxazin-4-one, 2,3-dihydro-3-propyl- is 191.09 g/mol.
Where can I buy 4H-1,3-Benzoxazin-4-one, 2,3-dihydro-3-propyl-?
You can request a quote for 4H-1,3-Benzoxazin-4-one, 2,3-dihydro-3-propyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4H-1,3-Benzoxazin-4-one, 2,3-dihydro-3-propyl-?
Yes, KEHONG BIO provides custom synthesis services for 4H-1,3-Benzoxazin-4-one, 2,3-dihydro-3-propyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.