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IDI1_022985 structure
Fine Chemical

IDI1_022985

TL;DR: IDI1_022985 (CAS 132038-98-3) is a chemical compound with molecular formula C18H25N9O2S and molecular weight 431.18518 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

N-[4,6-bis(propan-2-ylamino)-1,3,5-triazin-2-yl]-4-methyl-N-(1,2,4-triazol-4-yl)benzenesulfonamide

Also Known As: IDI1_022985, BAS 01258411, AB00568317-06, AE-848/32061023, BRD-K57049149-001-01-4

CAS Number
132038-98-3
Molecular Formula
C18H25N9O2S
Molecular Weight
431.18518 g/mol
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Technical Specifications

Molecular FormulaC18H25N9O2S
Molecular Weight431.18518 g/mol
XLogP3.1
Topological Polar Surface Area (TPSA)139.0 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors10
Rotatable Bonds8
Exact Mass431.18518 Da
Heavy Atoms30
Complexity610.0
SMILESCC1=CC=C(C=C1)S(=O)(=O)N(C2=NC(=NC(=N2)NC(C)C)NC(C)C)N3C=NN=C3
InChIKeySTLDQGAXAZXNGU-UHFFFAOYSA-N

Chemical Property Profile of IDI1_022985

XLogP
3.1
TPSA (Topological Polar Surface Area)
139.0
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
10
Rotatable Bonds
8
Heavy Atoms
30
Complexity
610.0
Exact Mass
431.18518
Monoisotopic Mass
431.18518
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 IDI1_022985

The XLogP value of 3.1 indicates that IDI1_022985 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 139.0 Ų falls within the moderate polarity range, balancing permeability and solubility for IDI1_022985. Following Lipinski's Rule of Five, IDI1_022985 has 2 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of IDI1_022985?

The CAS number of IDI1_022985 is 132038-98-3.

What is the molecular formula of IDI1_022985?

The molecular formula of IDI1_022985 is C18H25N9O2S.

What is the molecular weight of IDI1_022985?

The molecular weight of IDI1_022985 is 431.18518 g/mol.

Where can I buy IDI1_022985?

You can request a quote for IDI1_022985 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for IDI1_022985?

Yes, CoreyChem provides custom synthesis services for IDI1_022985 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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