Name: Name:2H-1,5-Benzodiazepin-2-one, 1,3-dihydro-4-(4-methyl-1-piperazinyl)-3-(2-oxopropylidene)-, (3Z)-
Brand: AABLOCKS
SKU: AA00058U
Rating: 90 (10 reviews)

Catalog No.:AA00058U

1017241-34-7 | 2H-1,5-Benzodiazepin-2-one, 1,3-dihydro-4-(4-methyl-1-piperazinyl)-3-(2-oxopropylidene)-, (3Z)-

Pack Size

Purity

Availability

Price(USD)

Quantity

1mg

≥95%

in stock

$355.00 $249.00

- +

Technical Information
Properties
Literature
Request for Quotation
Q & A

Technical Information
Properties
Literature

Technical Information

Catalog Number:

AA00058U

Chemical Name:

2H-1,5-Benzodiazepin-2-one, 1,3-dihydro-4-(4-methyl-1-piperazinyl)-3-(2-oxopropylidene)-, (3Z)-

CAS Number:

1017241-34-7

Molecular Formula:

C17H20N4O2

Molecular Weight:

312.3663

MDL Number:

MFCD21363737

IUPAC Name:

3-[(Z)-2-hydroxyprop-1-enyl]-4-(4-methylpiperazin-1-yl)-1,5-benzodiazepin-2-one

InChI:

InChI=1S/C17H20N4O2/c1-12(22)11-13-16(21-9-7-20(2)8-10-21)18-14-5-3-4-6-15(14)19-17(13)23/h3-6,11,22H,7-10H2,1-2H3/b12-11-

InChI Key:

CVKVZGLTQPNIEY-QXMHVHEDSA-N

SMILES:

CN1CCN(CC1)c1nc2ccccc2[nH]c(=O)/c/1=C\C(=O)C

Properties

Computed Properties

Complexity:

702

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

312.159g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

312.373g/mol

Monoisotopic Mass:

312.159g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

68.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.8

Synonyms

Olanzapine Lactam Impurity

1017241-34-7

(Z)-4-(4-Methylpiperazin-1-yl)-3-(2-oxopropylidene)-1H-benzo[b][1,4]diazepin-2(3H)-one

RT-017505

J-000486

2H-1,5-Benzodiazepin-2-one, 1,3-dihydro-4-(4-methyl-1-piperazinyl)-3-(2-oxopropylidene)-, (3Z)-

Literature

Quotation Request

Q & A