BAS 00394103
TL;DR: BAS 00394103 (CAS 329716-92-9) is a chemical compound with molecular formula C13H15NO3 and molecular weight 233.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(2-hydroxyethyl)spiro[4-azatricyclo[5.2.1.02,6]dec-8-ene-10,1'-cyclopropane]-3,5-dione
Also Known As: BAS 00394103, 4-(2-hydroxyethyl)-spiro[4-azatricyclo[5.2.1.0~2,6~]dec-8-ene-10,1'-cyclopropane]-3,5-dione, A1194/0055015, 4-(2-hydroxyethyl)spiro[4-azatricyclo[5.2.1.02,6]dec-8-ene-10,1'-cyclopropane]-3,5-dione, 2-(2-hydroxyethyl)-3a,4,7,7a-tetrahydro-1H-spiro[2-aza-4,7-methanoisoindole-8,1'-cyclopropane]-1,3(2H)-dione
| Molecular Formula | C13H15NO3 |
|---|---|
| Molecular Weight | 233.11 g/mol |
| LogP | 0.1759 |
| Topological Polar Surface Area | 57.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 233.1052 |
| Heavy Atoms | 17 |
| Complexity | 417.58093 |
Chemical Identifiers
| CAS Number | 329716-92-9 |
|---|---|
| SMILES | C1CC12C3C=CC2C4C3C(=O)N(C4=O)CCO |
Product Overview
BAS 00394103 (CAS 329716-92-9), with molecular formula C13H15NO3 and molecular weight 233.11 g/mol. IUPAC: 4-(2-hydroxyethyl)spiro[4-azatricyclo[5.2.1.02,6]dec-8-ene-10,1'-cyclopropane]-3,5-dione.
Chemical Property Profile of BAS 00394103
Property Insights of BAS 00394103
The XLogP value of 0.1759 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 00394103. With a topological polar surface area (TPSA) of 57.61 Ų, BAS 00394103 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00394103 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 BAS 00394103?
The CAS number of BAS 00394103 is 329716-92-9.
What is the molecular formula of BAS 00394103?
The molecular formula of BAS 00394103 is C13H15NO3.
What is the molecular weight of BAS 00394103?
The molecular weight of BAS 00394103 is 233.11 g/mol.
Where can I buy BAS 00394103?
You can request a quote for BAS 00394103 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00394103?
Yes, KEHONG BIO provides custom synthesis services for BAS 00394103 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.