CS-1004732
Cyclopenta[b]pyrrole-2-carboxylic acid, 1-[2-[[1-(ethoxycarbonyl)-3-phenylpropyl]amino]-1-oxopropyl]octahydro-, [2S-[1[R*(R*)],2α,3aα,6aα]]-
Manufacturer: ChemScene
CAS Number: 753405-33-3
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Purity
98%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₂₃H₃₂N₂O₅
Molecular Weight
416.51
Synonyms
None
SMILES
C([C@@H](N[C@@H](CCC1=CC=CC=C1)C(OCC)=O)C)(=O)N2[C@]3([C@@](C[C@H]2C(O)=O)(CCC3)[H])[H]
Tpsa
95.94
Logp
2.3832
H Acceptors
5
H Donors
2
Rotatable Bonds
9
SAFETY INFORMATION
ghsPictogramUrl
https://dev-s3.chemscene.com/web-image/physicalization/irritant.svg
Pictograms
Signal Word
Warning
UN Number
N/A
Class
N/A
Packing Group
N/A
Hazard Statements
Precautionary Statements
P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
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Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₃H₃₂N₂O₅
Molecular Weight: 416.51
Synonyms: None
SMILES: C([C@@H](N[C@@H](CCC1=CC=CC=C1)C(OCC)=O)C)(=O)N2[C@]3([C@@](C[C@H]2C(O)=O)(CCC3)[H])[H]
Tpsa: 95.94
Logp: 2.3832
H Acceptors: 5
H Donors: 2
Rotatable Bonds: 9
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₃H₃₂N₂O₅
Molecular Weight:
416.51
Synonyms:
None
SMILES:
C([C@@H](N[C@@H](CCC1=CC=CC=C1)C(OCC)=O)C)(=O)N2[C@]3([C@@](C[C@H]2C(O)=O)(CCC3)[H])[H]
Tpsa:
95.94
Logp:
2.3832
H Acceptors:
5
H Donors:
2
Rotatable Bonds:
9
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₁₇NO₆S
Molecular Weight: 303.33
Synonyms: None
SMILES: [C@H]([C@@H](C)O)(C(O)=O)[C@]1(N=C(C(O)=O)\C(=C\CCCO)\S1)[H]
Tpsa: 127.42
Logp: 0.3229
H Acceptors: 6
H Donors: 4
Rotatable Bonds: 7
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₁₇NO₆S
Molecular Weight:
303.33
Synonyms:
None
SMILES:
[C@H]([C@@H](C)O)(C(O)=O)[C@]1(N=C(C(O)=O)\C(=C\CCCO)\S1)[H]
Tpsa:
127.42
Logp:
0.3229
H Acceptors:
6
H Donors:
4
Rotatable Bonds:
7
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₁₉ClN₂O₂
Molecular Weight: 270.76
Synonyms: None
SMILES: O=C(OCCN(CC)CC)C1=CC=C(Cl)C(N)=C1
Tpsa: 55.56
Logp: 2.4208
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 6
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₁₉ClN₂O₂
Molecular Weight:
270.76
Synonyms:
None
SMILES:
O=C(OCCN(CC)CC)C1=CC=C(Cl)C(N)=C1
Tpsa:
55.56
Logp:
2.4208
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
6
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₂H₂₇NO₄
Molecular Weight: 369.45
Synonyms: None
SMILES: OC1=CC=C(C=C1OCC)CC2=NCCC=3C=C(OCC)C(OCC)=CC23
Tpsa: 60.28
Logp: 4.1762
H Acceptors: 5
H Donors: 1
Rotatable Bonds: 8
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₂H₂₇NO₄
Molecular Weight:
369.45
Synonyms:
None
SMILES:
OC1=CC=C(C=C1OCC)CC2=NCCC=3C=C(OCC)C(OCC)=CC23
Tpsa:
60.28
Logp:
4.1762
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
8