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Home > Other Heterocycles > 1956426-25-7
1956426-25-7 | (Z)-tert-Butyl (3-isopropyl-4-oxo-1,3,7-triazaspiro[4.5]decan-2-ylidene)carbamate
CAS No: 1956426-25-7 Catalog No: AG01D914 MDL No:
Product Description
Catalog Number:
AG01D914
Chemical Name:
(Z)-tert-Butyl (3-isopropyl-4-oxo-1,3,7-triazaspiro[4.5]decan-2-ylidene)carbamate
CAS Number:
1956426-25-7
Molecular Formula:
C15H26N4O3
Molecular Weight:
310.3919
IUPAC Name:
tert-butyl N-(4-oxo-3-propan-2-yl-1,3,9-triazaspiro[4.5]dec-1-en-2-yl)carbamate
InChI:
InChI=1S/C15H26N4O3/c1-10(2)19-11(20)15(7-6-8-16-9-15)18-12(19)17-13(21)22-14(3,4)5/h10,16H,6-9H2,1-5H3,(H,17,18,21)
InChI Key:
BBUSRPAAJLOXRA-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)NC1=NC2(C(=O)N1C(C)C)CCCNC2
Properties
Complexity:
496
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
310.2g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
310.398g/mol
Monoisotopic Mass:
310.2g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
83A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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