CAS RN: 150971-37-2

(S)-(6,6′-Dimethoxy-[1,1′-biphenyl]-2,2′-diyl)bis(bis(3,5-bis(trimethylsilyl)phenyl)phosphine)

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6 package records3 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20251122 100mg In stock Shenzhen, Chengdu Inquiry
Batchno.20250617 1g In stock Shenzhen, Tianjin, Chengdu Inquiry
Batchno.20260122 250mg In stock Shenzhen, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20260228 50mg Out of stock Inquiry
Batchno.20250122 50mg / 250mg Out of stock 5-7 business days Inquiry
Batchno.20250719 5g Out of stock Inquiry
  • Product code: starshine_CAS150971-37-2
  • Purity/Analytical Methods: >99.0%
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150971-37-2 / [2-[2-bis[3,5-bis(trimethylsilyl)phenyl]phosphanyl-6-methoxyphenyl]-3-methoxyphenyl]-bis[3,5-bis(trimethylsilyl)phenyl]phosphane

Standard CAS: 150971-37-2 Multi CAS: No

Basic Information

CAS
150971-37-2
Multi CAS
No
Molecular Formula
C62H96O2P2Si8
Molecular Weight
1160.000000
Exact Mass
1158.503969
SMILES
COC1=C(C(=CC=C1)P(C2=CC(=CC(=C2)[Si](C)(C)C)[Si](C)(C)C)C3=CC(=CC(=C3)[Si](C)(C)C)[Si](C)(C)C)C4=C(C=CC=C4P(C5=CC(=CC(=C5)[Si](C)(C)C)[Si](C)(C)C)C6=CC(=CC(=C6)[Si](C)(C)C)[Si](C)(C)C)OC
InChI
InChI=1S/C62H96O2P2Si8/c1-63-57-29-27-31-59(65(45-33-49(67(3,4)5)41-50(34-45)68(6,7)8)46-35-51(69(9,10)11)42-52(36-46)70(12,13)14)61(57)62-58(64-2)30-28-32-60(62)66(47-37-53(71(15,16)17)43-54(38-47)72(18,19)20)48-39-55(73(21,22)23)44-56(40-48)74(24,25)26/h27-44H,1-26H3
InChIKey
AKIJKAXWEBWVJE-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
74
Aromatic heavy atom count
36
Fraction Csp3
0.42
Rotatable bonds
17
H-bond acceptors
2
Molar refractivity
366.23
TPSA
18.46

LogP / Solubility

WLOGP
11.25
MLOGP
10.01
XLogP3
11.25
Consensus LogP
10.84
Log S (ESOL)
-13.36
Class (ESOL)
Insoluble
Log S (Ali)
-17.19
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-18.58
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-1.81

Drug-likeness / Medicinal Chemistry

Lipinski
No
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.17
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
5.5

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