[email protected]
CAS 607739-93-5 B-[4-(3,6-Diphenyl-9H-carbazol-9-yl)phenyl]boronic acid molecular structure lightbox
CAS RN: 607739-93-5

B-[4-(3,6-Diphenyl-9H-carbazol-9-yl)phenyl]boronic acid

  • Product code: SSC-169432
GET A QUOTE
Historical Factory Record

Historical Supply Reference

This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.

  • Pack sizes on record: 1g
  • Available purity: ≥95%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
Request Bulk Quote

Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 607739-93-5
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Hong Kong Inquiry

607739-93-5 / [4-(3,6-diphenylcarbazol-9-yl)phenyl]boronic acid

Standard CAS: 607739-93-5 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
607739-93-5
Multi CAS
No
Molecular Formula
BC30H22NO2
Molecular Weight
439.300000
Exact Mass
439.174359
InChI
InChI=1S/C30H22BNO2/c33-31(34)25-13-15-26(16-14-25)32-29-17-11-23(21-7-3-1-4-8-21)19-27(29)28-20-24(12-18-30(28)32)22-9-5-2-6-10-22/h1-20,33-34H
InChIKey
MDJFBPQHRZJLCC-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
34
Aromatic heavy atom count
31
Rotatable bonds
4
H-bond acceptors
3
H-bond donors
2
Molar refractivity
141.48
TPSA
45.39

LogP / Solubility

WLOGP
5.8
MLOGP
5.13
XLogP3
5.8
Consensus LogP
5.58
Log S (ESOL)
-6.63
Class (ESOL)
Insoluble
Log S (Ali)
-7.35
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-7.81
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-1.28

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
4

Customers Also Viewed

Get In Touch

Contact Us