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CAS 849924-52-3 (S)-1-{(R)-2-[BIS(4-METHOXY-3,5-DIMETHYLPHENYL)PHOSPHINO]FERROCENYL}-ETHYLBIS(2- molecular structure lightbox
CAS RN: 849924-52-3

(S)-1-{(R)-2-[BIS(4-METHOXY-3,5-DIMETHYLPHENYL)PHOSPHINO]FERROCENYL}-ETHYLBIS(2-

Product Availability

Choose a grade to view its available package options.

5 package records4 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20251227 100mg In stock Shanghai, Tianjin Inquiry
Batchno.20260313 1g In stock Shanghai Inquiry
Batchno.20251215 250mg In stock Shanghai Inquiry
Batchno.20250602 50mg In stock Shanghai Inquiry
Batchno.20260608 50mg / 100mg / 250mg Out of stock 8-10 business days Inquiry
  • Product code: SSC-192780
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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: 0.25g
  • Available purity: ＞97%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
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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 849924-52-3
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.25g ＞97% 0 Out of Stock Shenzhen Inquiry

849924-52-3 / (S)-1-{(R)-2-[BIS(4-METHOXY-3,5-DIMETHYLPHENYL)PHOSPHINO]FERROCENYL}-ETHYLBIS(2-

Standard CAS: 849924-52-3 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
849924-52-3
Multi CAS
Yes
Molecular Formula
C44H42FEO2P2
Molecular Weight
720.600000
Exact Mass
720.200940
InChI
InChI=1S/C39H42O2P2.C5.Fe/c1-25-15-10-12-18-35(25)42(36-19-13-11-16-26(36)2)31(7)34-17-14-20-37(34)43(32-21-27(3)38(40-8)28(4)22-32)33-23-29(5)39(41-9)30(6)24-33;1-2-4-5-3-1;/h10-16,18-24,31H,1-9H3;;/q2*-1;+2/t31-;;/m0../s1
InChIKey
IOBZZAODVAYOOW-ATQCJDTDSA-N

Computed Properties

Structural Parameters

Heavy atom count
49
Aromatic heavy atom count
18
Fraction Csp3
0.23
Rotatable bonds
9
H-bond acceptors
2
Molar refractivity
205.46
TPSA
18.46

LogP / Solubility

WLOGP
9.73
MLOGP
8.63
XLogP3
9.73
Consensus LogP
9.36
Log S (ESOL)
-10.12
Class (ESOL)
Insoluble
Log S (Ali)
-12.49
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-13.5
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)
-0.21

Drug-likeness / Medicinal Chemistry

Lipinski
No
Ghose
No
Veber
Yes
Egan
No
Muegge
No
Bioavailability score
0.17
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
6.5

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