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BV6

BV6 structure

CAS No:
1001600-56-1
Formula:
C70H96N10O8.xCF3COOH
Chemical Name:
BV6
Synonyms:
BV6;N,N'-(hexane-1,6-diyl)bis(1-{(2S)-2-cyclohexyl-2-[(N-methyl-L-alanyl)amino]acetyl}-L-prolyl-beta-phenyl-L-phenylalaninamide):trifluoroacetic acid(1:x);4,4'-(1,6-Hexanediyl)bis[N-methyl-L-alanyl-(2S)-2-cyclohexylglycyl-L-prolyl-beta-phenyl-L-phenylalaninamide
Categories:
Biochemical Engineering > Inhibitors

Description

N,N'-(hexane-1,6-diyl)bis(1-{(2S)-2-cyclohexyl-2-[(N-methyl-L-alanyl)amino]acetyl}-L-prolyl-beta-phenyl-L-phenylalaninamide) is a polyamide consisting of hexane-1,6-diamine having a 1-{(2S)-2-cyclohexyl-2-[(N-methyl-L-alanyl)amino]acetyl}-L-prolyl-beta-phenyl-L-phenylalanyl moiety attached to both nitrogens. It derives from a methyl 1-{(2S)-2-cyclohexyl-2-[(N-methyl-L-alanyl)amino]acetyl}-L-prolyl-beta-phenyl-L-phenylalaninate.

BV6 Basic Attributes

Molecular Weight：

1205.6

Exact Mass：

1204.741

Characteristics

PSA：

239

XLogP3：

9.5

Density：

1.177±0.06 g/cm3(Predicted)

Boiling Point：

1376.7±65.0 °C(Predicted)

Computed Properties

Molecular Weight:1205.6
XLogP3:9.5
Hydrogen Bond Donor Count:8
Hydrogen Bond Acceptor Count:10
Rotatable Bond Count:29
Exact Mass:1204.74126006
Monoisotopic Mass:1204.74126006
Topological Polar Surface Area:239
Heavy Atom Count:88
Complexity:2030
Defined Atom Stereocenter Count:8
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes