Name: Name:10H-Thieno[2,3-b][1,5]benzodiazepine-2-methanol, 4-(4-methyl-1-piperazinyl)-
Brand: Angene
SKU: AG001ZX9
Rating: 90 (10 reviews)

10H-Thieno[2,3-b][1,5]benzodiazepine-2-methanol, 4-(4-methyl-1-piperazinyl)-

CAS No.:

174756-45-7

Catalog Number:

AG001ZX9

Molecular Formula:

C17H20N4OS

Molecular Weight:

328.4319

Catalog Number:

AG001ZX9

Chemical Name:

10H-Thieno[2,3-b][1,5]benzodiazepine-2-methanol, 4-(4-methyl-1-piperazinyl)-

CAS Number:

174756-45-7

Molecular Formula:

C17H20N4OS

Molecular Weight:

328.4319

MDL Number:

MFCD12031369

IUPAC Name:

[4-(4-methylpiperazin-1-yl)-10H-thieno[2,3-b][1,5]benzodiazepin-2-yl]methanol

InChI:

InChI=1S/C17H20N4OS/c1-20-6-8-21(9-7-20)16-13-10-12(11-22)23-17(13)19-15-5-3-2-4-14(15)18-16/h2-5,10,19,22H,6-9,11H2,1H3

InChI Key:

FPDIERBPQFAFSI-UHFFFAOYSA-N

SMILES:

OCc1sc2c(c1)C(=Nc1c(N2)cccc1)N1CCN(CC1)C

UNII:

SZB3TH928Y

Complexity:

452

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

328.136g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

328.434g/mol

Monoisotopic Mass:

328.136g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

79.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.6