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CAS 1212132-10-9 TRANS (+/-) 1-[(TERT-BUTYL)OXYCARBONYL]-4-(3-PYRIDYL)PYRROLIDINE-3-CARBOXYLIC ACID molecular structure lightbox
CAS RN: 1212132-10-9

TRANS (+/-) 1-[(TERT-BUTYL)OXYCARBONYL]-4-(3-PYRIDYL)PYRROLIDINE-3-CARBOXYLIC ACID

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250501 100mg / 250mg / 1g Out of stock 8-10 business days Inquiry
  • Product code: SSC-022978
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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: ≥95%
  • 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 1212132-10-9
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.25g ≥95% 0 Out of Stock Shenzhen Inquiry

1212132-10-9 / (3R,4S)-1-[(2-methylpropan-2-yl)oxycarbonyl]-4-pyridin-3-ylpyrrolidine-3-carboxylic acid

TRANS (+/-) 1-[(TERT-BUTYL)OXYCARBONYL]-4-(3-PYRIDYL)PYRROLIDINE-3-CARBOXYLIC ACID | MFCD06659319 | SCHEMBL16780094

Standard CAS: 1212132-10-9 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
1212132-10-9
Multi CAS
Yes
Molecular Formula
C15H20N2O4
Molecular Weight
292.330000
Exact Mass
292.142307
SMILES
CC(C)(C)OC(=O)N1C[C@@H]([C@H](C1)C(=O)O)C2=CN=CC=C2
InChI
InChI=1S/C15H20N2O4/c1-15(2,3)21-14(20)17-8-11(12(9-17)13(18)19)10-5-4-6-16-7-10/h4-7,11-12H,8-9H2,1-3H3,(H,18,19)/t11-,12+/m0/s1
InChIKey
SJINPULFJCWKFE-NWDGAFQWSA-N
Synonyms
TRANS (+/-) 1-[(TERT-BUTYL)OXYCARBONYL]-4-(3-PYRIDYL)PYRROLIDINE-3-CARBOXYLIC ACID MFCD06659319 SCHEMBL16780094 SCHEMBL30513217 AR1340

Computed Properties

Structural Parameters

Heavy atom count
21
Aromatic heavy atom count
6
Fraction Csp3
0.53
Rotatable bonds
2
H-bond acceptors
4
H-bond donors
1
Molar refractivity
75.91
TPSA
79.73

LogP / Solubility

WLOGP
2.12
MLOGP
1.87
XLogP3
1.1
Consensus LogP
1.7
Log S (ESOL)
-3.07
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.49
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.56
Class (SILICOS-IT)
Poorly soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
3.5

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