白坚木原碱
TL;DR: 白坚木原碱 (CAS 2912-09-6) is a chemical compound with molecular formula C19H26N2 and molecular weight 282.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
白坚木原碱
12-ethyl-8,16-diazapentacyclo[10.6.1.01,9.02,7.016,19]nonadeca-2,4,6-triene
Also Known As: Aspidospermidine, (+)-Aspidospermidine, 12-ethyl-8,16-diazapentacyclo[10.6.1.01,9.02,7.016,19]nonadeca-2,4,6-triene, 1H-Indolizino[8,1-cd]carbazole, aspidospermidine deriv., [3aR-(3a.alpha.,5a.beta.,10bR*,13a.alpha.)]-3a-Ethyl-2,3,3a,4,5,5a,6, 11,12,13a-decahydro-1H-indolizino[8,1-cd]carbazole
| Molecular Formula | C19H26N2 |
|---|---|
| Molecular Weight | 282.21 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 15.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 282.2096 |
| Heavy Atoms | 21 |
| Complexity | 435.0 |
Chemical Identifiers
| CAS Number | 2912-09-6 |
|---|---|
| SMILES | CCC12CCCN3C1C4(CC3)C(CC2)NC5=CC=CC=C45 |
| InChIKey | YAAIPCQYJYPITK-UHFFFAOYSA-N |
Product Overview
白坚木原碱 (CAS 2912-09-6), with molecular formula C19H26N2 and molecular weight 282.21 g/mol. IUPAC: 12-ethyl-8,16-diazapentacyclo[10.6.1.01,9.02,7.016,19]nonadeca-2,4,6-triene.
Chemical Property Profile of 白坚木原碱
Property Insights of 白坚木原碱
The XLogP value of 4.0 indicates that 白坚木原碱 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 15.3 Ų, 白坚木原碱 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 白坚木原碱 has 1 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 白坚木原碱?
The CAS number of 白坚木原碱 is 2912-09-6.
What is the molecular formula of 白坚木原碱?
The molecular formula of 白坚木原碱 is C19H26N2.
What is the molecular weight of 白坚木原碱?
The molecular weight of 白坚木原碱 is 282.21 g/mol.
Where can I buy 白坚木原碱?
You can request a quote for 白坚木原碱 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 白坚木原碱?
Yes, KEHONG BIO provides custom synthesis services for 白坚木原碱 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.