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1,3,3-trimethyl-8'-nitro-1,3-dihydrospiro[indole-2,3'-naphtho[2,1-b][1,4]oxazine] structure
Fine Chemical

1,3,3-trimethyl-8'-nitro-1,3-dihydrospiro[indole-2,3'-naphtho[2,1-b][1,4]oxazine]

TL;DR: 1,3,3-trimethyl-8'-nitro-1,3-dihydrospiro[indole-2,3'-naphtho[2,1-b][1,4]oxazine] (CAS 121456-71-1) is a chemical compound with molecular formula C22H19N3O3 and molecular weight 373.14264 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

1',3',3'-trimethyl-8-nitrospiro[benzo[f][1,4]benzoxazine-3,2'-indole]

Also Known As: 1,3,3-trimethyl-8'-nitro-1,3-dihydrospiro[indole-2,3'-naphtho[2,1-b][1,4]oxazine], 1',3',3'-trimethyl-8-nitrospiro[benzo[f][1,4]benzoxazine-3,2'-indole], 1,3,3-Trimethyl-8 -nitrospiro[indoline-2,3 -[3H]naphth[2,1-b][1,4]oxazine], 8-Nitro-1 ,3 ,3 -trimethylspiro[3H-naphtho[2,1-b][1,4]oxazine-3,2 -indoline], 1 ,3 ,3 -Trimethyl-8-nitrospiro[3H-naphtho[2,1-b][1,4]oxazine-3,2 (3 H)-[1H]indole]

CAS Number
121456-71-1
Molecular Formula
C22H19N3O3
Molecular Weight
373.14264 g/mol
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Technical Specifications

Molecular FormulaC22H19N3O3
Molecular Weight373.14264 g/mol
XLogP4.9
Topological Polar Surface Area (TPSA)70.7 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors5
Rotatable Bonds0
Exact Mass373.14264 Da
Heavy Atoms28
Complexity674.0
SMILESCC1(C2=CC=CC=C2N(C13C=NC4=C(O3)C=CC5=C4C=CC(=C5)[N+](=O)[O-])C)C
InChIKeyWMTKWGIAGGCKSS-UHFFFAOYSA-N

Chemical Property Profile of 1,3,3-trimethyl-8'-nitro-1,3-dihydrospiro[indole-2,3'-naphtho[2,1-b][1,4]oxazine]

XLogP
4.9
TPSA (Topological Polar Surface Area)
70.7
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
5
Rotatable Bonds
0
Heavy Atoms
28
Complexity
674.0
Exact Mass
373.14264
Monoisotopic Mass
373.14264
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 1,3,3-trimethyl-8'-nitro-1,3-dihydrospiro[indole-2,3'-naphtho[2,1-b][1,4]oxazine]

The XLogP value of 4.9 indicates that 1,3,3-trimethyl-8'-nitro-1,3-dihydrospiro[indole-2,3'-naphtho[2,1-b][1,4]oxazine] is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3,3-trimethyl-8'-nitro-1,3-dihydrospiro[indole-2,3'-naphtho[2,1-b][1,4]oxazine]. Following Lipinski's Rule of Five, 1,3,3-trimethyl-8'-nitro-1,3-dihydrospiro[indole-2,3'-naphtho[2,1-b][1,4]oxazine] has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 1,3,3-trimethyl-8'-nitro-1,3-dihydrospiro[indole-2,3'-naphtho[2,1-b][1,4]oxazine]?

The CAS number of 1,3,3-trimethyl-8'-nitro-1,3-dihydrospiro[indole-2,3'-naphtho[2,1-b][1,4]oxazine] is 121456-71-1.

What is the molecular formula of 1,3,3-trimethyl-8'-nitro-1,3-dihydrospiro[indole-2,3'-naphtho[2,1-b][1,4]oxazine]?

The molecular formula of 1,3,3-trimethyl-8'-nitro-1,3-dihydrospiro[indole-2,3'-naphtho[2,1-b][1,4]oxazine] is C22H19N3O3.

What is the molecular weight of 1,3,3-trimethyl-8'-nitro-1,3-dihydrospiro[indole-2,3'-naphtho[2,1-b][1,4]oxazine]?

The molecular weight of 1,3,3-trimethyl-8'-nitro-1,3-dihydrospiro[indole-2,3'-naphtho[2,1-b][1,4]oxazine] is 373.14264 g/mol.

Where can I buy 1,3,3-trimethyl-8'-nitro-1,3-dihydrospiro[indole-2,3'-naphtho[2,1-b][1,4]oxazine]?

You can request a quote for 1,3,3-trimethyl-8'-nitro-1,3-dihydrospiro[indole-2,3'-naphtho[2,1-b][1,4]oxazine] directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 1,3,3-trimethyl-8'-nitro-1,3-dihydrospiro[indole-2,3'-naphtho[2,1-b][1,4]oxazine]?

Yes, CoreyChem provides custom synthesis services for 1,3,3-trimethyl-8'-nitro-1,3-dihydrospiro[indole-2,3'-naphtho[2,1-b][1,4]oxazine] and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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