N-[(Z)-[(Z)-2-chloro-3-phenylprop-2-enylidene]amino]-1,4,5,6-tetrahydrocyclopenta[c]pyrazole-3-carboxamide

Formula:C16H15N4OCl Mutagenic:none Tumorigenic:none Reproductive Effective:none N-[(Z)-[(Z)-2-chloro-3-phenylprop-2-enylidene]amino]-1,4,5,6-tetrahydrocyclopenta[c]pyrazole-3-carboxamide is a drug-like molecule.

MolName	N-[(Z)-[(Z)-2-chloro-3-phenylprop-2-enylidene]amino]-1,4,5,6-tetrahydrocyclopenta[c]pyrazole-3-carboxamide
MolecularFormula	C16H15N4OCl
Smiles	O=C(c1n[nH]c2c1CCC2)N/N=C\C(\Cl)=C\c1ccccc1
InChI	InChI=1S/C16H15ClN4O/c17-12(9-11-5-2-1-3-6-11)10-18-21-16(22)15-13-7-4-8-14(13)19-20-15/h1-3,5-6,9-10H,4,7-8H2,(H,19,20)(H,21,22)
InChIK	CTJRRWPMFKKTNH-UHFFFAOYSA-N
TotalMolweight	314.775
Molweight	314.775
MonoisotopicMass	314.093438
CLogP	2.4979
CLogS	-4.147
H Acceptors	5
H Donors	2
TotalSurfaceArea	243.23
Relative PSA	0.25067
PolarSurfaceArea	70.14
Druglikeness	3.6176
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.63636
Fragments	1
Non HAtoms	22
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	4
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	11
Sp3Atoms	3
Symmetricatoms	2
Aromatic Nitrogens	2
StereoCon

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1 - N-[(Z)-[(Z)-2-chloro-3-phenylprop-2-enylidene]amino]-1,4,5,6-tetrahydrocyclopenta[c]pyrazole-3-carboxamide | 2 - N-[(Z)-[(Z)-2-chloro-3-phenylprop-2-enylidene]amino]-1,4,5,6-tetrahydrocyclopenta[c]pyrazole-3-carboxamide

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