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Anticancer agent 129 structure
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Anticancer agent 129

TL;DR: Anticancer agent 129 (CAS 135882-37-0) is a chemical compound with molecular formula C18H17N3 and molecular weight 275.14224 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

1-benzyl-2,3-dihydropyrrolo[2,3-b]quinolin-4-amine

Also Known As: Anticancer agent 129, Anticancer agent 129?, BAS 00526270, 1-benzyl-2,3-dihydro-1H-pyrrolo[2,3-b]quinolin-4-amine, 1-benzyl-2,3-dihydropyrrolo[2,3-b]quinolin-4-amine

CAS Number
135882-37-0
Molecular Formula
C18H17N3
Molecular Weight
275.14224 g/mol
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Application Areas

Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.

Heterocyclic Building Blocks (14 patents) Pharmaceutical Intermediates (15 patents)

Technical Specifications

Molecular FormulaC18H17N3
Molecular Weight275.14224 g/mol
XLogP3.5
Topological Polar Surface Area (TPSA)42.2 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors3
Rotatable Bonds2
Exact Mass275.14224 Da
Heavy Atoms21
Complexity352.0
SMILESC1CN(C2=NC3=CC=CC=C3C(=C21)N)CC4=CC=CC=C4
InChIKeyZCZQCKJQIGWLFR-UHFFFAOYSA-N

Chemical Property Profile of Anticancer agent 129

XLogP
3.5
TPSA (Topological Polar Surface Area)
42.2
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
3
Rotatable Bonds
2
Heavy Atoms
21
Complexity
352.0
Exact Mass
275.14224
Monoisotopic Mass
275.14224
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of Anticancer agent 129

The XLogP value of 3.5 indicates that Anticancer agent 129 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.2 Ų, Anticancer agent 129 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Anticancer agent 129 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

What is the CAS number of Anticancer agent 129?

The CAS number of Anticancer agent 129 is 135882-37-0.

What is the molecular formula of Anticancer agent 129?

The molecular formula of Anticancer agent 129 is C18H17N3.

What is the molecular weight of Anticancer agent 129?

The molecular weight of Anticancer agent 129 is 275.14224 g/mol.

Where can I buy Anticancer agent 129?

You can request a quote for Anticancer agent 129 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Anticancer agent 129?

Yes, CoreyChem provides custom synthesis services for Anticancer agent 129 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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