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Arborine

Arborine structure

CAS No:
6873-15-0
Formula:
C16H14N2O
Chemical Name:
Arborine
Synonyms:
4(1H)-Quinazolinone,1-methyl-2-(phenylmethyl)-;4(1H)-Quinazolinone,2-benzyl-1-methyl-;Arborine;1-Methyl-2-(phenylmethyl)-4(1H)-quinazolinone;Glycosine (alkaloid);Glycosine;Arborin;Glycosin;NSC 127745;2-Benzyl-1-methylquinazolin-4-one;2-Benzyl-1-methylquinazolin-4(1H)-one
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

Description

Arborine, isolated from Glycosmis arborea, inhibits the peripheral action of acetylcholine and induces a fall in blood pressure[1][1].

Solid

Arborine is a member of quinazolines.

Arborine Basic Attributes

Molecular Weight：

250.301

Exact Mass：

250.30

UNII：

D5JUH3HNWF

NSC Number：

127745

DSSTox ID：

DTXSID10218856

Characteristics

PSA：

34.89000

XLogP3：

2.25

Appearance：

Solid

Density：

1.2±0.1 g/cm3

Melting Point：

155-156 °C

Boiling Point：

421.0±38.0 °C at 760 mmHg

Flash Point：

208.4±26.8 °C

Refractive Index：

1.622

Water Solubility：

9.349 mg/L @ 25 °C (est)

Drug Information

MeSH Entry Terms：

arborine

Computed Properties

Molecular Weight:250.29
XLogP3:2.5
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:2
Exact Mass:250.110613074
Monoisotopic Mass:250.110613074
Topological Polar Surface Area:32.7
Heavy Atom Count:19
Complexity:371
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes