Compound C25H30FN3O

1-(4-fluorophenyl)-4-(3-methyl-4,7,17-triazatricyclo[8.7.0.011,16]heptadeca-1(10),11,13,15-tetraen-6-yl)butan-1-one

CAS: 101247-79-4

Molecular Formula	`C25H30FN3O`
Molecular Weight	407.5 g/mol
LogP	4.1
Topological Polar Surface Area	56.9 A2
Hydrogen Bond Donors	3
Hydrogen Bond Acceptors	4
Rotatable Bonds	5
Exact Mass	407.2373
Heavy Atoms	30
Complexity	551.0

Chemical Identifiers

CAS Number	101247-79-4
SMILES	`CC1CC2=C(CCNC(CN1)CCCC(=O)C3=CC=C(C=C3)F)C4=CC=CC=C4N2`
InChIKey	`NELXIQANQPYCSY-UHFFFAOYSA-N`

📖 Product Overview

Compound C25H30FN3O (CAS: 101247-79-4) is a chemical compound with molecular formula C25H30FN3O and molecular weight 407.5 g/mol. Its IUPAC systematic name is 1-(4-fluorophenyl)-4-(3-methyl-4,7,17-triazatricyclo[8.7.0.011,16]heptadeca-1(10),11,13,15-tetraen-6-yl)butan-1-one. LogP 4.1 Topological Polar Surface Area 56.9 A2 Hydrogen Bond Donors 3 Hydrogen Bond Acceptors 4 Rotatable Bonds 5 Exact Mass 407.2373 Heavy Atoms 30 Complexity 551.0 InChI Key: NELXIQANQPYCSY-UHFFFAOYSA-N. SMILES: CC1CC2=C(CCNC(CN1)CCCC(=O)C3=CC=C(C=C3)F)C4=CC=CC=C4N2.

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