Pyrrolo[2,3-b]indole, 1,2,3,3a,8,8a-hexahydro-3a-methyl-, (3aS-cis)-
TL;DR: Pyrrolo[2,3-b]indole, 1,2,3,3a,8,8a-hexahydro-3a-methyl-, (3aS-cis)- (CAS 858450-40-5) is a chemical compound with molecular formula C11H14N2 and molecular weight 174.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8b-methyl-2,3,3a,4-tetrahydro-1H-pyrrolo[2,3-b]indole
Also Known As: J2.708.710H, 3a-methyl-1,2,3,3a,8,8a-hexahydro-pyrrolo[2,3-b]indole, 3a-Methyl-1,2,3,3a,8,8a-hexahydropyrrolo[2,3-b]indole, 3a-methyl-1H,2H,3H,3aH,8H,8aH-pyrrolo[2,3-b]indole, 1,2,3,3a,8,8a-hexahydro-3a-methylpyrrolo[2,3-b]indole
| Molecular Formula | C11H14N2 |
|---|---|
| Molecular Weight | 174.12 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 24.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 174.11569 |
| Heavy Atoms | 13 |
| Complexity | 216.0 |
Chemical Identifiers
| CAS Number | 858450-40-5 |
|---|---|
| SMILES | CC12CCNC1NC3=CC=CC=C23 |
| InChIKey | QREOKCMNEWNKLU-UHFFFAOYSA-N |
Product Overview
Pyrrolo[2,3-b]indole, 1,2,3,3a,8,8a-hexahydro-3a-methyl-, (3aS-cis)- (CAS 858450-40-5), with molecular formula C11H14N2 and molecular weight 174.12 g/mol. IUPAC: 8b-methyl-2,3,3a,4-tetrahydro-1H-pyrrolo[2,3-b]indole.
Chemical Property Profile of Pyrrolo[2,3-b]indole, 1,2,3,3a,8,8a-hexahydro-3a-methyl-, (3aS-cis)-
Property Insights of Pyrrolo[2,3-b]indole, 1,2,3,3a,8,8a-hexahydro-3a-methyl-, (3aS-cis)-
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pyrrolo[2,3-b]indole, 1,2,3,3a,8,8a-hexahydro-3a-methyl-, (3aS-cis)-. With a topological polar surface area (TPSA) of 24.1 Ų, Pyrrolo[2,3-b]indole, 1,2,3,3a,8,8a-hexahydro-3a-methyl-, (3aS-cis)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pyrrolo[2,3-b]indole, 1,2,3,3a,8,8a-hexahydro-3a-methyl-, (3aS-cis)- has 2 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 Pyrrolo[2,3-b]indole, 1,2,3,3a,8,8a-hexahydro-3a-methyl-, (3aS-cis)-?
The CAS number of Pyrrolo[2,3-b]indole, 1,2,3,3a,8,8a-hexahydro-3a-methyl-, (3aS-cis)- is 858450-40-5.
What is the molecular formula of Pyrrolo[2,3-b]indole, 1,2,3,3a,8,8a-hexahydro-3a-methyl-, (3aS-cis)-?
The molecular formula of Pyrrolo[2,3-b]indole, 1,2,3,3a,8,8a-hexahydro-3a-methyl-, (3aS-cis)- is C11H14N2.
What is the molecular weight of Pyrrolo[2,3-b]indole, 1,2,3,3a,8,8a-hexahydro-3a-methyl-, (3aS-cis)-?
The molecular weight of Pyrrolo[2,3-b]indole, 1,2,3,3a,8,8a-hexahydro-3a-methyl-, (3aS-cis)- is 174.12 g/mol.
Where can I buy Pyrrolo[2,3-b]indole, 1,2,3,3a,8,8a-hexahydro-3a-methyl-, (3aS-cis)-?
You can request a quote for Pyrrolo[2,3-b]indole, 1,2,3,3a,8,8a-hexahydro-3a-methyl-, (3aS-cis)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyrrolo[2,3-b]indole, 1,2,3,3a,8,8a-hexahydro-3a-methyl-, (3aS-cis)-?
Yes, KEHONG BIO provides custom synthesis services for Pyrrolo[2,3-b]indole, 1,2,3,3a,8,8a-hexahydro-3a-methyl-, (3aS-cis)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.