Name: Name:3,4,5,9-tetraazatricyclo[8.4.0.0,3,7]tetradeca-1(14),4,6,10,12-pentaene
Brand: Angene
SKU: AG01B1RC
Rating: 90 (10 reviews)

3,4,5,9-tetraazatricyclo[8.4.0.0,3,7]tetradeca-1(14),4,6,10,12-pentaene

CAS No.:

127933-85-1

Catalog Number:

AG01B1RC

Molecular Formula:

C10H10N4

Molecular Weight:

186.2132

Catalog Number:

AG01B1RC

Chemical Name:

3,4,5,9-tetraazatricyclo[8.4.0.0,3,7]tetradeca-1(14),4,6,10,12-pentaene

CAS Number:

127933-85-1

Molecular Formula:

C10H10N4

Molecular Weight:

186.2132

MDL Number:

MFCD20678312

IUPAC Name:

5,10-dihydro-4H-triazolo[5,1-c][1,4]benzodiazepine

InChI:

InChI=1S/C10H10N4/c1-2-4-10-8(3-1)7-14-9(5-11-10)6-12-13-14/h1-4,6,11H,5,7H2

InChI Key:

NMQROUTYOYSSRM-UHFFFAOYSA-N

SMILES:

c1ccc2c(c1)Cn1nncc1CN2

Complexity:

208

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

186.091g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

186.218g/mol

Monoisotopic Mass:

186.091g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

42.7A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.9