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1233025-87-0

1233025-87-0 | 6-Quinazolineacetic acid, 4-(1-piperidinyl)-

CAS No: 1233025-87-0 Catalog No: AG000KAT MDL No:

Product Description

Catalog Number:
AG000KAT
Chemical Name:
6-Quinazolineacetic acid, 4-(1-piperidinyl)-
CAS Number:
1233025-87-0
Molecular Formula:
C15H17N3O2
Molecular Weight:
271.3144
IUPAC Name:
2-(4-piperidin-1-ylquinazolin-6-yl)acetic acid
InChI:
InChI=1S/C15H17N3O2/c19-14(20)9-11-4-5-13-12(8-11)15(17-10-16-13)18-6-2-1-3-7-18/h4-5,8,10H,1-3,6-7,9H2,(H,19,20)
InChI Key:
GUJVKXQAQFUVKH-UHFFFAOYSA-N
SMILES:
OC(=O)Cc1ccc2c(c1)c(ncn2)N1CCCCC1

Properties

Complexity:
344  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
271.132g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
271.32g/mol
Monoisotopic Mass:
271.132g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
66.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  

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