(1R,2R,5S,6S,7S,8R)-N-(4-(4-(2-Pyrimidinyl)-1-piperazinyl)butyl)tricyclo[4.2.2.02,5]deca-3,9-diene-7,8-dicarboximide

Modify Date: 2024-01-22 18:21:13

(1R,2R,5S,6S,7S,8R)-N-(4-(4-(2-Pyrimidinyl)-1-piperazinyl)butyl)tricyclo[4.2.2.02,5]deca-3,9-diene-7,8-dicarboximide structure	Common Name	(1R,2R,5S,6S,7S,8R)-N-(4-(4-(2-Pyrimidinyl)-1-piperazinyl)butyl)tricyclo[4.2.2.02,5]deca-3,9-diene-7,8-dicarboximide
	CAS Number	114374-97-9	Molecular Weight	455.98000
	Density	1.3±0.1 g/cm3	Boiling Point	652.8±65.0 °C at 760 mmHg
	Molecular Formula	C₂₄H₃₀ClN₅O₂	Melting Point	N/A
	MSDS	N/A	Flash Point	348.6±34.3 °C

Name	(1R,2R,5S,6S,7S,8R)-N-(4-(4-(2-Pyrimidinyl)-1-piperazinyl)butyl)tricyclo[4.2.2.02,5]deca-3,9-diene-7,8-dicarboximide
Synonym	More Synonyms

Density	1.3±0.1 g/cm3
Boiling Point	652.8±65.0 °C at 760 mmHg
Molecular Formula	C₂₄H₃₀ClN₅O₂
Molecular Weight	455.98000
Flash Point	348.6±34.3 °C
Exact Mass	455.20900
PSA	69.64000
LogP	2.78
Vapour Pressure	0.0±2.0 mmHg at 25°C
Index of Refraction	1.616
InChIKey	XQINQMZXDOSBBV-FDPNZRBCSA-N
SMILES	Cl.O=C1C2C3C=CC(C4C=CC43)C2C(=O)N1CCCCN1CCN(c2ncccn2)CC1

(3aR,4R,4aS,6aR,7S,7aS)-2-{4-[4-(pyrimidin-2-yl)piperazin-1-yl]butyl}-3a,4,4a,6a,7,7a-hexahydro-1H-4,7-ethenocyclobuta[f]isoindole-1,3(2H)-dione

4,7-Etheno-1H-cyclobut[f]isoindole-1,3(2H)-dione, 3a,4,4a,6a,7,7a-hexahydro-2-[4-[4-(2-pyrimidinyl)-1-piperazinyl]butyl]-, (3aR,4R,4aS,6aR,7S,7aS)-

(1R,2R,6S,7S,8R,11S)-4-{4-[4-(2-Pyrimidinyl)-1-piperazinyl]butyl}-4-azatetracyclo[5.4.2.0.0]trideca-9,12-diene-3,5-dione

(1R*,2R*,5S*,6S*,7S*,8R*)-N-(4-(4-(2-Pyrimidinyl)-1-piperazinyl)butyl)tricyclo[4.2.2.02,5]deca-3,9-diene-7,8-dicarboximide

(3aa,4a,4ab,6ab,7a,7aa)-3a,4,4a,6a,7,7a-Hexahydro-2-(4-(4-(2-pyrimidinyl)-1-piperazinyl)butyl)-4,7-etheno-1H-cyclobut[f]isoindole-1,3(2H)-dione

(1R,2R,6S,7S,8R,11S)-4-{4-[4-(Pyrimidin-2-yl)piperazin-1-yl]butyl}-4-azatetracyclo[5.4.2.0.0]trideca-9,12-diene-3,5-dione

Names