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2-chloro-4-(morpholin-4-yl)pyrrolo[2,1-f][1,2,4]triazine-6-carbaldehyde

2-chloro-4-(morpholin-4-yl)pyrrolo[2,1-f][1,2,4]triazine-6-carbaldehyde

CAS: 1401334-36-8

Formula: C11H11ClN4O2

SMILES: ClC1=NN2C=C(C=O)C=C2C(=N1)N1CCOCC1

IUPAC: 2-chloro-4-(morpholin-4-yl)pyrrolo[2,1-f][1,2,4]triazine-6-carbaldehyde

InChI: InChI=1S/C11H11ClN4O2/c12-11-13-10(15-1-3-18-4-2-15)9-5-8(7-17)6-16(9)14-11/h5-7H,1-4H2

Composition: C (49.54%), H (4.16%), Cl (13.29%), N (21.01%), O (12.00%)

Molar Mass: 266.69

Atom Count: 29

Heavy Atom Count: 18

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 266.0570533
Formal Charge 0
FSP3 0.36
Hetero Ring Count 3
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 0
InChIKey XYUWQCGFGUQFSR-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 80.7
Topological Polar Surface Area 59.73
Polarizability 25.52
Ring Count 3
Rotatable Bond Count 2

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