Name: Name:1-{[1-(propan-2-yl)-1H-pyrazol-5-yl]imino}-1H-isoindol-3-amine
Brand: Angene
SKU: AG019JQK
Rating: 90 (10 reviews)

1-{[1-(propan-2-yl)-1H-pyrazol-5-yl]imino}-1H-isoindol-3-amine

CAS No.:

1004417-78-0

Catalog Number:

AG019JQK

Molecular Formula:

C14H15N5

Molecular Weight:

253.3024

Catalog Number:

AG019JQK

Chemical Name:

1-{[1-(propan-2-yl)-1H-pyrazol-5-yl]imino}-1H-isoindol-3-amine

CAS Number:

1004417-78-0

Molecular Formula:

C14H15N5

Molecular Weight:

253.3024

MDL Number:

MFCD07308551

IUPAC Name:

3-(2-propan-2-ylpyrazol-3-yl)iminoisoindol-1-amine

InChI:

InChI=1S/C14H15N5/c1-9(2)19-12(7-8-16-19)17-14-11-6-4-3-5-10(11)13(15)18-14/h3-9H,1-2H3,(H2,15,17,18)

InChI Key:

ZKTXPQQBUQOAGW-UHFFFAOYSA-N

SMILES:

CC(n1nccc1N=C1N=C(c2c1cccc2)N)C

Complexity:

401

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

253.133g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

253.309g/mol

Monoisotopic Mass:

253.133g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

68.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.6