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CAS 1400149-69-0 (2R)-1-(diphenylphosphino)-3-Methyl-2-ButanaMine molecular structure lightbox
CAS RN: 1400149-69-0

(2R)-1-(diphenylphosphino)-3-Methyl-2-ButanaMine

Product Availability

Choose a grade to view its available package options.

8 package records6 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250809 100mg In stock Inquiry
Batchno.20260410 1g Out of stock Inquiry
Batchno.20251117 250mg In stock Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250613 100mg In stock Shanghai, Wuhan, Chengdu Inquiry
Batchno.20250409 1g In stock Shanghai Inquiry
Batchno.20250830 250mg In stock Shanghai Inquiry
Batchno.20250720 50mg In stock Shanghai Inquiry
Batchno.20250911 50mg / 100mg / 250mg / 1g Out of stock 8-10 business days Inquiry
  • Product code: SSC-050486
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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 1400149-69-0
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.25g ＞97% 0 Out of Stock Shanghai Inquiry

1400149-69-0 / (2R)-1-diphenylphosphanyl-3-methylbutan-2-amine

Standard CAS: 1400149-69-0 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
1400149-69-0
Multi CAS
No
Molecular Formula
C17H22NP
Molecular Weight
271.340000
Exact Mass
271.148987
SMILES
CC(C)[C@H](CP(C1=CC=CC=C1)C2=CC=CC=C2)N
InChI
InChI=1S/C17H22NP/c1-14(2)17(18)13-19(15-9-5-3-6-10-15)16-11-7-4-8-12-16/h3-12,14,17H,13,18H2,1-2H3/t17-/m0/s1
InChIKey
ZZLCXURCZWQECA-KRWDZBQOSA-N

Computed Properties

Structural Parameters

Heavy atom count
19
Aromatic heavy atom count
12
Fraction Csp3
0.29
Rotatable bonds
5
H-bond acceptors
1
H-bond donors
1
Molar refractivity
86.75
TPSA
26.02

LogP / Solubility

WLOGP
3.1
MLOGP
2.74
XLogP3
3.5
Consensus LogP
3.11
Log S (ESOL)
-3.61
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.03
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.6
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.17

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
2

Safety & Transport

Pictogram(s)
Corrosive
Signal
Danger
GHS Hazard Statements
H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]
Precautionary Statement Codes
P260, P264, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P363, P405, and P501

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