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2-(4-aminobenzyl)tetrahydro-1H-pyrrolo[1,2-c]imidazole-1,3(2H)-dione structure
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2-(4-aminobenzyl)tetrahydro-1H-pyrrolo[1,2-c]imidazole-1,3(2H)-dione

TL;DR: 2-(4-aminobenzyl)tetrahydro-1H-pyrrolo[1,2-c]imidazole-1,3(2H)-dione (CAS 1008080-37-2) is a chemical compound with molecular formula C13H15N3O2 and molecular weight 245.11642 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

2-[(4-aminophenyl)methyl]-5,6,7,7a-tetrahydropyrrolo[1,2-c]imidazole-1,3-dione

Also Known As: ZERO/005816, 2-(4-aminobenzyl)tetrahydro-1H-pyrrolo[1,2-c]imidazole-1,3(2H)-dione, 2-[(4-aminophenyl)methyl]-5,6,7,7a-tetrahydropyrrolo[1,2-c]imidazole-1,3-dione, 2-(4-Amino-benzyl)-tetrahydro-pyrrolo[1,2-c]imidazole-1,3-dione, 2-(4-aminobenzyl)tetrahydro-1{H}-pyrrolo[1,2-{c}]imidazole-1,3(2{H})-dione

CAS Number
1008080-37-2
Molecular Formula
C13H15N3O2
Molecular Weight
245.11642 g/mol
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Technical Specifications

Molecular FormulaC13H15N3O2
Molecular Weight245.11642 g/mol
XLogP0.7
Topological Polar Surface Area (TPSA)66.6 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors3
Rotatable Bonds2
Exact Mass245.11642 Da
Heavy Atoms18
Complexity363.0
SMILESC1CC2C(=O)N(C(=O)N2C1)CC3=CC=C(C=C3)N
InChIKeyUZKMXLCYYHVHRC-UHFFFAOYSA-N

Chemical Property Profile of 2-(4-aminobenzyl)tetrahydro-1H-pyrrolo[1,2-c]imidazole-1,3(2H)-dione

XLogP
0.7
TPSA (Topological Polar Surface Area)
66.6
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
3
Rotatable Bonds
2
Heavy Atoms
18
Complexity
363.0
Exact Mass
245.11642
Monoisotopic Mass
245.11642
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 2-(4-aminobenzyl)tetrahydro-1H-pyrrolo[1,2-c]imidazole-1,3(2H)-dione

The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-aminobenzyl)tetrahydro-1H-pyrrolo[1,2-c]imidazole-1,3(2H)-dione. The TPSA of 66.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-aminobenzyl)tetrahydro-1H-pyrrolo[1,2-c]imidazole-1,3(2H)-dione. Following Lipinski's Rule of Five, 2-(4-aminobenzyl)tetrahydro-1H-pyrrolo[1,2-c]imidazole-1,3(2H)-dione 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 2-(4-aminobenzyl)tetrahydro-1H-pyrrolo[1,2-c]imidazole-1,3(2H)-dione?

The CAS number of 2-(4-aminobenzyl)tetrahydro-1H-pyrrolo[1,2-c]imidazole-1,3(2H)-dione is 1008080-37-2.

What is the molecular formula of 2-(4-aminobenzyl)tetrahydro-1H-pyrrolo[1,2-c]imidazole-1,3(2H)-dione?

The molecular formula of 2-(4-aminobenzyl)tetrahydro-1H-pyrrolo[1,2-c]imidazole-1,3(2H)-dione is C13H15N3O2.

What is the molecular weight of 2-(4-aminobenzyl)tetrahydro-1H-pyrrolo[1,2-c]imidazole-1,3(2H)-dione?

The molecular weight of 2-(4-aminobenzyl)tetrahydro-1H-pyrrolo[1,2-c]imidazole-1,3(2H)-dione is 245.11642 g/mol.

Where can I buy 2-(4-aminobenzyl)tetrahydro-1H-pyrrolo[1,2-c]imidazole-1,3(2H)-dione?

You can request a quote for 2-(4-aminobenzyl)tetrahydro-1H-pyrrolo[1,2-c]imidazole-1,3(2H)-dione directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 2-(4-aminobenzyl)tetrahydro-1H-pyrrolo[1,2-c]imidazole-1,3(2H)-dione?

Yes, CoreyChem provides custom synthesis services for 2-(4-aminobenzyl)tetrahydro-1H-pyrrolo[1,2-c]imidazole-1,3(2H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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